1-(aminomethyl)-N-(6-methoxy-3-pyridinyl)cyclopentane-1-carboxamide

C13H19N3O2 — CID 55037854

IUPAC1-(aminomethyl)-N-(6-methoxy-3-pyridinyl)cyclopentane-1-carboxamide
SMILESCOc1ccc(NC(=O)C2(CN)CCCC2)cn1
InChIInChI=1S/C13H19N3O2/c1-18-11-5-4-10(8-15-11)16-12(17)13(9-14)6-2-3-7-13/h4-5,8H,2-3,6-7,9,14H2,1H3,(H,16,17)
InChIKeyGIAWVTNHQIFEGP-UHFFFAOYSA-N
MW249.31 g/mol
LogP1.55
Rot. Bonds4

About 1-(aminomethyl)-N-(6-methoxy-3-pyridinyl)cyclopentane-1-carboxamide

1-(aminomethyl)-N-(6-methoxy-3-pyridinyl)cyclopentane-1-carboxamide (PubChem CID 55037854) has the molecular formula C13H19N3O2 and a molecular weight of 249.31 g/mol. Its IUPAC name is 1-(aminomethyl)-N-(6-methoxy-3-pyridinyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(aminomethyl)-N-(6-methoxy-3-pyridinyl)cyclopentane-1-carboxamide
PubChem CID55037854
Molecular FormulaC13H19N3O2
Molecular Weight249.31 g/mol
Exact Mass249.15
IUPAC Name1-(aminomethyl)-N-(6-methoxy-3-pyridinyl)cyclopentane-1-carboxamide
SMILESCOc1ccc(NC(=O)C2(CN)CCCC2)cn1
InChIInChI=1S/C13H19N3O2/c1-18-11-5-4-10(8-15-11)16-12(17)13(9-14)6-2-3-7-13/h4-5,8H,2-3,6-7,9,14H2,1H3,(H,16,17)
InChIKeyGIAWVTNHQIFEGP-UHFFFAOYSA-N
XLogP1.55
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(aminomethyl)-N-[6-(2-methoxyethoxy)-3-pyridinyl]cyclopentane-1-carboxamide
CID 115434828
1-[[(6-methoxy-3-pyridinyl)carbamoylamino]methyl]cyclopentane-1-carboxylic acid
CID 115433896
1-(aminomethyl)-N-(3,5-dimethoxyphenyl)cyclobutane-1-carboxamide
CID 80588722
N-(6-methoxy-3-pyridinyl)-2,2,5-trimethyl-1,3-dioxane-5-carboxamide
CID 100779083
1-(aminomethyl)-N-(4-fluoro-3-methoxyphenyl)cycloheptane-1-carboxamide
CID 114839160
N-[6-(2-methoxyethoxy)-3-pyridinyl]-1-methylcyclohexane-1-carboxamide
CID 99621153
4-(aminomethyl)-N-[6-(4-fluorophenoxy)-3-pyridinyl]oxane-4-carboxamide
CID 120939094
N-(6-methoxy-3-pyridinyl)-1-prop-1-ynylcyclopropane-1-carboxamide
CID 57158284
1-amino-N-[6-(4-methoxyphenoxy)-3-pyridinyl]cyclopentane-1-carboxamide
CID 119893826
1-amino-N-[6-(2-methoxyethoxy)-3-pyridinyl]cyclohexane-1-carboxamide
CID 43704144
1-(2,4-dichlorophenyl)-N-(6-methoxy-3-pyridinyl)cyclohexane-1-carboxamide
CID 100771662
1-(aminomethyl)-N-[4-(carbamoylamino)phenyl]cyclohexane-1-carboxamide
CID 115437417

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-(6-methoxy-3-pyridinyl)cyclopentane-1-carboxamide?
The IUPAC name of 1-(aminomethyl)-N-(6-methoxy-3-pyridinyl)cyclopentane-1-carboxamide (CID 55037854) is 1-(aminomethyl)-N-(6-methoxy-3-pyridinyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-(aminomethyl)-N-(6-methoxy-3-pyridinyl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-(aminomethyl)-N-(6-methoxy-3-pyridinyl)cyclopentane-1-carboxamide is COc1ccc(NC(=O)C2(CN)CCCC2)cn1.
What is the InChIKey of 1-(aminomethyl)-N-(6-methoxy-3-pyridinyl)cyclopentane-1-carboxamide?
The InChIKey is GIAWVTNHQIFEGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2/c1-18-11-5-4-10(8-15-11)16-12(17)13(9-14)6-2-3-7-13/h4-5,8H,2-3,6-7,9,14H2,1H3,(H,16,17).
What are the key properties of 1-(aminomethyl)-N-(6-methoxy-3-pyridinyl)cyclopentane-1-carboxamide?
1-(aminomethyl)-N-(6-methoxy-3-pyridinyl)cyclopentane-1-carboxamide has a molecular weight of 249.31 g/mol, XLogP of 1.55, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-(6-methoxy-3-pyridinyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 55037854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).