6-chloro-5-(cyclopropylmethoxy)-N-[2-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyridine-2-carboxamide

C18H21ClN4O3 — CID 118418657

IUPAC6-chloro-5-(cyclopropylmethoxy)-N-[2-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyridine-2-carboxamide
SMILESCc1nc(C(CC2CC2)NC(=O)c2ccc(OCC3CC3)c(Cl)n2)no1
InChIInChI=1S/C18H21ClN4O3/c1-10-20-17(23-26-10)14(8-11-2-3-11)22-18(24)13-6-7-15(16(19)21-13)25-9-12-4-5-12/h6-7,11-12,14H,2-5,8-9H2,1H3,(H,22,24)
InChIKeyICTBZAIOHWBBHG-UHFFFAOYSA-N
MW376.84 g/mol
LogP3.49
Rot. Bonds8

About 6-chloro-5-(cyclopropylmethoxy)-N-[2-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyridine-2-carboxamide

6-chloro-5-(cyclopropylmethoxy)-N-[2-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyridine-2-carboxamide (PubChem CID 118418657) has the molecular formula C18H21ClN4O3 and a molecular weight of 376.84 g/mol. Its IUPAC name is 6-chloro-5-(cyclopropylmethoxy)-N-[2-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-chloro-5-(cyclopropylmethoxy)-N-[2-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyridine-2-carboxamide
PubChem CID118418657
Molecular FormulaC18H21ClN4O3
Molecular Weight376.84 g/mol
Exact Mass376.13
IUPAC Name6-chloro-5-(cyclopropylmethoxy)-N-[2-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyridine-2-carboxamide
SMILESCc1nc(C(CC2CC2)NC(=O)c2ccc(OCC3CC3)c(Cl)n2)no1
InChIInChI=1S/C18H21ClN4O3/c1-10-20-17(23-26-10)14(8-11-2-3-11)22-18(24)13-6-7-15(16(19)21-13)25-9-12-4-5-12/h6-7,11-12,14H,2-5,8-9H2,1H3,(H,22,24)
InChIKeyICTBZAIOHWBBHG-UHFFFAOYSA-N
XLogP3.49
TPSA90.14 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.84
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 6-chloro-5-(cyclopropylmethoxy)-N-[2-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-cyclopropyl-N-[2-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-6-(2-methylpropylsulfonyl)pyridine-2-carboxamide
CID 78010190
5-cyclopropyl-6-(cyclopropylmethoxy)-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyridine-2-carboxamide
CID 78010149
6-(cyclopropylmethoxy)-N-[cyclopropyl-(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-5-(trifluoromethyl)pyridine-2-carboxamide
CID 71105660
N-[(R)-cyclopropen-1-yl-(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-5-cyclopropyl-6-(cyclopropylmethoxy)pyridine-2-carboxamide
CID 134424121
[5-cyclopropyl-6-(2-methylpropylsulfonyl)-2-pyridinyl] N-[(1S)-2-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]carbamate
CID 121347227
6-(4-chlorophenyl)-5-(cyclopropylmethoxy)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)propan-2-yl]pyridine-2-carboxamide
CID 118418676
1-N,4-N-bis[1-(5-methyl-1,2,4-oxadiazol-3-yl)propyl]benzene-1,4-dicarboxamide
CID 166219715
[5-cyclopropyl-6-(cyclopropylmethoxy)-2-pyridinyl] N-[cyclopropyl-(5-methyl-1,2,4-oxadiazol-3-yl)methyl]carbamate
CID 121347109
3,5-dichloro-N-[(1S)-1-(5-methyl-1,2,4-oxadiazol-3-yl)propyl]benzamide
CID 95786298
[5-cyclopropyl-6-[(4-fluorophenyl)methyl]-2-pyridinyl] N-[(1S)-2-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]carbamate
CID 121347130
[6-(cyclopropylmethoxy)-5-(trifluoromethyl)-2-pyridinyl] N-[cyclopropyl-(5-methyl-1,2,4-oxadiazol-3-yl)methyl]carbamate
CID 121347083
N-[(S)-(4-chlorophenyl)-(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide
CID 97157679

Frequently Asked Questions

What is the IUPAC name of 6-chloro-5-(cyclopropylmethoxy)-N-[2-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyridine-2-carboxamide?
The IUPAC name of 6-chloro-5-(cyclopropylmethoxy)-N-[2-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyridine-2-carboxamide (CID 118418657) is 6-chloro-5-(cyclopropylmethoxy)-N-[2-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyridine-2-carboxamide.
What is the SMILES notation for 6-chloro-5-(cyclopropylmethoxy)-N-[2-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyridine-2-carboxamide?
The canonical SMILES for 6-chloro-5-(cyclopropylmethoxy)-N-[2-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyridine-2-carboxamide is Cc1nc(C(CC2CC2)NC(=O)c2ccc(OCC3CC3)c(Cl)n2)no1.
What is the InChIKey of 6-chloro-5-(cyclopropylmethoxy)-N-[2-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyridine-2-carboxamide?
The InChIKey is ICTBZAIOHWBBHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21ClN4O3/c1-10-20-17(23-26-10)14(8-11-2-3-11)22-18(24)13-6-7-15(16(19)21-13)25-9-12-4-5-12/h6-7,11-12,14H,2-5,8-9H2,1H3,(H,22,24).
What are the key properties of 6-chloro-5-(cyclopropylmethoxy)-N-[2-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyridine-2-carboxamide?
6-chloro-5-(cyclopropylmethoxy)-N-[2-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyridine-2-carboxamide has a molecular weight of 376.84 g/mol, XLogP of 3.49, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-5-(cyclopropylmethoxy)-N-[2-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyridine-2-carboxamide is sourced from PubChem (CID 118418657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).