N-ethyl-4-(ethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide

C15H23N3O2 — CID 62179440

IUPACN-ethyl-4-(ethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide
SMILESCCNc1ccnc(C(=O)N(CC)CC2CCCO2)c1
InChIInChI=1S/C15H23N3O2/c1-3-16-12-7-8-17-14(10-12)15(19)18(4-2)11-13-6-5-9-20-13/h7-8,10,13H,3-6,9,11H2,1-2H3,(H,16,17)
InChIKeyPUMXAJWYFQQBBL-UHFFFAOYSA-N
MW277.37 g/mol
LogP2.15
Rot. Bonds6

About N-ethyl-4-(ethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide

N-ethyl-4-(ethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide (PubChem CID 62179440) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-ethyl-4-(ethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-4-(ethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide
PubChem CID62179440
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-ethyl-4-(ethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide
SMILESCCNc1ccnc(C(=O)N(CC)CC2CCCO2)c1
InChIInChI=1S/C15H23N3O2/c1-3-16-12-7-8-17-14(10-12)15(19)18(4-2)11-13-6-5-9-20-13/h7-8,10,13H,3-6,9,11H2,1-2H3,(H,16,17)
InChIKeyPUMXAJWYFQQBBL-UHFFFAOYSA-N
XLogP2.15
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-4-(methylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide
CID 62179439
4-(ethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide
CID 62173174
N-ethyl-5-(ethylamino)-N-(oxolan-2-ylmethyl)pyrazine-2-carboxamide
CID 107374808
N-ethyl-5-(methylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide
CID 104640524
2-amino-N-ethyl-N-(oxolan-2-ylmethyl)pyridine-4-carboxamide
CID 55041803
N,N-diethyl-4-(oxan-3-ylmethylamino)pyridine-2-carboxamide
CID 61019704
N-ethyl-2-[[ethyl(oxolan-2-ylmethyl)amino]methyl]pyridin-4-amine
CID 79245776
N-(cyclopropylmethyl)-N-ethyl-4-(propylamino)pyridine-2-carboxamide
CID 63939735
N-ethyl-2,3-difluoro-N-(oxolan-2-ylmethyl)pyridine-4-carboxamide
CID 114985398
5-bromo-N-ethyl-2-(ethylamino)-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide
CID 62179962
N-ethyl-5-(methylamino)-N-(oxolan-2-ylmethyl)pyrazine-2-carboxamide
CID 107374809
4-N,4-N-diethyl-2-N-(oxolan-2-ylmethyl)pyridine-2,4-dicarboxamide
CID 109083295

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-(ethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide?
The IUPAC name of N-ethyl-4-(ethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide (CID 62179440) is N-ethyl-4-(ethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide.
What is the SMILES notation for N-ethyl-4-(ethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide?
The canonical SMILES for N-ethyl-4-(ethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide is CCNc1ccnc(C(=O)N(CC)CC2CCCO2)c1.
What is the InChIKey of N-ethyl-4-(ethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide?
The InChIKey is PUMXAJWYFQQBBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-3-16-12-7-8-17-14(10-12)15(19)18(4-2)11-13-6-5-9-20-13/h7-8,10,13H,3-6,9,11H2,1-2H3,(H,16,17).
What are the key properties of N-ethyl-4-(ethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide?
N-ethyl-4-(ethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 2.15, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-(ethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide is sourced from PubChem (CID 62179440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).