N-[4-(aminomethyl)phenyl]-N-cyclopropyl-6-methylpyridine-2-carboxamide

C17H19N3O — CID 43276034

IUPACN-[4-(aminomethyl)phenyl]-N-cyclopropyl-6-methylpyridine-2-carboxamide
SMILESCc1cccc(C(=O)N(c2ccc(CN)cc2)C2CC2)n1
InChIInChI=1S/C17H19N3O/c1-12-3-2-4-16(19-12)17(21)20(15-9-10-15)14-7-5-13(11-18)6-8-14/h2-8,15H,9-11,18H2,1H3
InChIKeyCMAJOPFMHURQOF-UHFFFAOYSA-N
MW281.36 g/mol
LogP2.66
Rot. Bonds4

About N-[4-(aminomethyl)phenyl]-N-cyclopropyl-6-methylpyridine-2-carboxamide

N-[4-(aminomethyl)phenyl]-N-cyclopropyl-6-methylpyridine-2-carboxamide (PubChem CID 43276034) has the molecular formula C17H19N3O and a molecular weight of 281.36 g/mol. Its IUPAC name is N-[4-(aminomethyl)phenyl]-N-cyclopropyl-6-methylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-[4-(aminomethyl)phenyl]-N-cyclopropyl-6-methylpyridine-2-carboxamide
PubChem CID43276034
Molecular FormulaC17H19N3O
Molecular Weight281.36 g/mol
Exact Mass281.15
IUPAC NameN-[4-(aminomethyl)phenyl]-N-cyclopropyl-6-methylpyridine-2-carboxamide
SMILESCc1cccc(C(=O)N(c2ccc(CN)cc2)C2CC2)n1
InChIInChI=1S/C17H19N3O/c1-12-3-2-4-16(19-12)17(21)20(15-9-10-15)14-7-5-13(11-18)6-8-14/h2-8,15H,9-11,18H2,1H3
InChIKeyCMAJOPFMHURQOF-UHFFFAOYSA-N
XLogP2.66
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(aminomethyl)phenyl]-N-cyclopropylpyridine-2-carboxamide
CID 43276062
N-[4-(aminomethyl)phenyl]-N-cyclopropyl-5-fluoropyridine-2-carboxamide
CID 104637940
N-[4-(aminomethyl)phenyl]-N-cyclopropyl-1-methylimidazole-4-carboxamide
CID 107970828
ethyl N-[4-(aminomethyl)phenyl]-N-cyclopropylcarbamate
CID 43276107
N-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-ethoxyacetamide
CID 43276024
phenyl N-[4-(aminomethyl)phenyl]-N-cyclopropylcarbamate
CID 43276104
N-[(2-aminophenyl)methyl]-N-cyclopropyl-6-methylpyridine-2-carboxamide
CID 43460892
N-(2-aminoethyl)-N,6-dimethylpyridine-2-carboxamide
CID 61348528
N-cyclopropyl-N-phenylpyridine-2-carboxamide
CID 68859541
N-(2-amino-2-hydroxyiminoethyl)-N-cyclopentyl-6-methylpyridine-2-carboxamide
CID 77044653
N-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-(1-methoxycyclobutyl)acetamide
CID 103555309
N-[4-(aminomethyl)phenyl]-N-cyclopropyloxolane-2-carboxamide
CID 43276045

Frequently Asked Questions

What is the IUPAC name of N-[4-(aminomethyl)phenyl]-N-cyclopropyl-6-methylpyridine-2-carboxamide?
The IUPAC name of N-[4-(aminomethyl)phenyl]-N-cyclopropyl-6-methylpyridine-2-carboxamide (CID 43276034) is N-[4-(aminomethyl)phenyl]-N-cyclopropyl-6-methylpyridine-2-carboxamide.
What is the SMILES notation for N-[4-(aminomethyl)phenyl]-N-cyclopropyl-6-methylpyridine-2-carboxamide?
The canonical SMILES for N-[4-(aminomethyl)phenyl]-N-cyclopropyl-6-methylpyridine-2-carboxamide is Cc1cccc(C(=O)N(c2ccc(CN)cc2)C2CC2)n1.
What is the InChIKey of N-[4-(aminomethyl)phenyl]-N-cyclopropyl-6-methylpyridine-2-carboxamide?
The InChIKey is CMAJOPFMHURQOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O/c1-12-3-2-4-16(19-12)17(21)20(15-9-10-15)14-7-5-13(11-18)6-8-14/h2-8,15H,9-11,18H2,1H3.
What are the key properties of N-[4-(aminomethyl)phenyl]-N-cyclopropyl-6-methylpyridine-2-carboxamide?
N-[4-(aminomethyl)phenyl]-N-cyclopropyl-6-methylpyridine-2-carboxamide has a molecular weight of 281.36 g/mol, XLogP of 2.66, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(aminomethyl)phenyl]-N-cyclopropyl-6-methylpyridine-2-carboxamide is sourced from PubChem (CID 43276034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).