6-amino-3-chloro-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-2-carboxamide

C14H15ClN4O — CID 82744378

IUPAC6-amino-3-chloro-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-2-carboxamide
SMILESCCc1cccnc1CNC(=O)c1nc(N)ccc1Cl
InChIInChI=1S/C14H15ClN4O/c1-2-9-4-3-7-17-11(9)8-18-14(20)13-10(15)5-6-12(16)19-13/h3-7H,2,8H2,1H3,(H2,16,19)(H,18,20)
InChIKeyRHFVKGZRFUOONI-UHFFFAOYSA-N
MW290.75 g/mol
LogP2.20
Rot. Bonds4

About 6-amino-3-chloro-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-2-carboxamide

6-amino-3-chloro-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-2-carboxamide (PubChem CID 82744378) has the molecular formula C14H15ClN4O and a molecular weight of 290.75 g/mol. Its IUPAC name is 6-amino-3-chloro-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-amino-3-chloro-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-2-carboxamide
PubChem CID82744378
Molecular FormulaC14H15ClN4O
Molecular Weight290.75 g/mol
Exact Mass290.09
IUPAC Name6-amino-3-chloro-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-2-carboxamide
SMILESCCc1cccnc1CNC(=O)c1nc(N)ccc1Cl
InChIInChI=1S/C14H15ClN4O/c1-2-9-4-3-7-17-11(9)8-18-14(20)13-10(15)5-6-12(16)19-13/h3-7H,2,8H2,1H3,(H2,16,19)(H,18,20)
InChIKeyRHFVKGZRFUOONI-UHFFFAOYSA-N
XLogP2.20
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-amino-3-chloro-N-[(2-ethylphenyl)methyl]pyridine-2-carboxamide
CID 64694581
3-amino-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-2-carboxamide
CID 104742770
2,6-dichloro-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-3-carboxamide
CID 106994204
6-amino-3-chloro-N-ethylpyridine-2-carboxamide
CID 62154853
2-amino-5-chloro-N-[(3-ethyl-2-pyridinyl)methyl]benzamide
CID 82741526
3,6-dichloro-N-[(2-ethoxy-3-pyridinyl)methyl]pyridine-2-carboxamide
CID 38539806
6-amino-3-chloro-N-methylpyridine-2-carboxamide
CID 62156050
6-amino-3-chloro-N-[(5-methylpyrazin-2-yl)methyl]pyridine-2-carboxamide
CID 62841226
6-amino-3-chloro-N-(2-pyridin-2-ylethyl)pyridine-2-carboxamide
CID 62153756
2-amino-N-[(3-ethyl-2-pyridinyl)methyl]-5-fluorobenzamide
CID 82741369
4-amino-2-(ethylamino)-N-[(3-ethyl-2-pyridinyl)methyl]-1,3-thiazole-5-carboxamide
CID 116672026
N-[(3-ethyl-2-pyridinyl)methyl]-4-(methylamino)benzamide
CID 82743343

Frequently Asked Questions

What is the IUPAC name of 6-amino-3-chloro-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-2-carboxamide?
The IUPAC name of 6-amino-3-chloro-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-2-carboxamide (CID 82744378) is 6-amino-3-chloro-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-2-carboxamide.
What is the SMILES notation for 6-amino-3-chloro-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-2-carboxamide?
The canonical SMILES for 6-amino-3-chloro-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-2-carboxamide is CCc1cccnc1CNC(=O)c1nc(N)ccc1Cl.
What is the InChIKey of 6-amino-3-chloro-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-2-carboxamide?
The InChIKey is RHFVKGZRFUOONI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN4O/c1-2-9-4-3-7-17-11(9)8-18-14(20)13-10(15)5-6-12(16)19-13/h3-7H,2,8H2,1H3,(H2,16,19)(H,18,20).
What are the key properties of 6-amino-3-chloro-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-2-carboxamide?
6-amino-3-chloro-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-2-carboxamide has a molecular weight of 290.75 g/mol, XLogP of 2.20, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-3-chloro-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-2-carboxamide is sourced from PubChem (CID 82744378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).