1-(aminomethyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide

C11H15N3O — CID 80599055

IUPAC1-(aminomethyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide
SMILESCc1cc(NC(=O)C2(CN)CC2)ccn1
InChIInChI=1S/C11H15N3O/c1-8-6-9(2-5-13-8)14-10(15)11(7-12)3-4-11/h2,5-6H,3-4,7,12H2,1H3,(H,13,14,15)
InChIKeyKOIICUNCBYWQFJ-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.07
Rot. Bonds3

About 1-(aminomethyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide

1-(aminomethyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide (PubChem CID 80599055) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is 1-(aminomethyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-(aminomethyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide
PubChem CID80599055
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name1-(aminomethyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide
SMILESCc1cc(NC(=O)C2(CN)CC2)ccn1
InChIInChI=1S/C11H15N3O/c1-8-6-9(2-5-13-8)14-10(15)11(7-12)3-4-11/h2,5-6H,3-4,7,12H2,1H3,(H,13,14,15)
InChIKeyKOIICUNCBYWQFJ-UHFFFAOYSA-N
XLogP1.07
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(aminomethyl)-N-pyridin-4-ylcyclobutane-1-carboxamide
CID 80587391
1-[(2-methyl-4-pyridinyl)carbamoyl]cyclobutane-1-carboxylic acid
CID 79240228
3-methyl-N-(2-methyl-4-pyridinyl)pyrrolidine-3-carboxamide
CID 79240444
1-(aminomethyl)-N-(3-methyl-2-pyridinyl)cyclopropane-1-carboxamide
CID 80587648
1-[2-[(2-methyl-4-pyridinyl)amino]-2-oxoethyl]cyclohexane-1-carboxylic acid
CID 79235812
4-(aminomethyl)-N-[3-(4-methylpyrimidin-2-yl)phenyl]oxane-4-carboxamide
CID 120933382
4-(aminomethyl)-N-(2-phenyl-4-pyridinyl)oxane-4-carboxamide
CID 120941121
1-(aminomethyl)-N-[3-(1H-pyrazol-5-yl)phenyl]cyclopropane-1-carboxamide
CID 115452566
1-(aminomethyl)-N-thiophen-3-ylcyclopropane-1-carboxamide
CID 115453472
1-(aminomethyl)-N-(3-fluoro-5-methylphenyl)cyclopropane-1-carboxamide
CID 115453477
1-(aminomethyl)-N-(2,3-dioxo-1,4-dihydroquinoxalin-6-yl)cyclopropane-1-carboxamide
CID 115452525
1-(2-methoxyphenyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide
CID 110439650

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide?
The IUPAC name of 1-(aminomethyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide (CID 80599055) is 1-(aminomethyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-(aminomethyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-(aminomethyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide is Cc1cc(NC(=O)C2(CN)CC2)ccn1.
What is the InChIKey of 1-(aminomethyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide?
The InChIKey is KOIICUNCBYWQFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-8-6-9(2-5-13-8)14-10(15)11(7-12)3-4-11/h2,5-6H,3-4,7,12H2,1H3,(H,13,14,15).
What are the key properties of 1-(aminomethyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide?
1-(aminomethyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide has a molecular weight of 205.26 g/mol, XLogP of 1.07, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 80599055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).