N,N-diethyl-4-[(1-methylcyclopropyl)amino]pyridine-2-carboxamide

C14H21N3O — CID 113485597

IUPACN,N-diethyl-4-[(1-methylcyclopropyl)amino]pyridine-2-carboxamide
SMILESCCN(CC)C(=O)c1cc(NC2(C)CC2)ccn1
InChIInChI=1S/C14H21N3O/c1-4-17(5-2)13(18)12-10-11(6-9-15-12)16-14(3)7-8-14/h6,9-10H,4-5,7-8H2,1-3H3,(H,15,16)
InChIKeyRSAHPYHRPRHZPM-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.53
Rot. Bonds5

About N,N-diethyl-4-[(1-methylcyclopropyl)amino]pyridine-2-carboxamide

N,N-diethyl-4-[(1-methylcyclopropyl)amino]pyridine-2-carboxamide (PubChem CID 113485597) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is N,N-diethyl-4-[(1-methylcyclopropyl)amino]pyridine-2-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-4-[(1-methylcyclopropyl)amino]pyridine-2-carboxamide
PubChem CID113485597
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC NameN,N-diethyl-4-[(1-methylcyclopropyl)amino]pyridine-2-carboxamide
SMILESCCN(CC)C(=O)c1cc(NC2(C)CC2)ccn1
InChIInChI=1S/C14H21N3O/c1-4-17(5-2)13(18)12-10-11(6-9-15-12)16-14(3)7-8-14/h6,9-10H,4-5,7-8H2,1-3H3,(H,15,16)
InChIKeyRSAHPYHRPRHZPM-UHFFFAOYSA-N
XLogP2.53
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-diethyl-4-(propylamino)pyridine-2-carboxamide
CID 43395263
2-[[2-(diethylcarbamoyl)-4-pyridinyl]amino]oxyacetic acid
CID 115572227
N,N-diethyl-4-(2-methylbutylamino)pyridine-2-carboxamide
CID 62693747
2-[[2-(diethylcarbamoyl)-4-pyridinyl]amino]propanoic acid
CID 43517392
N,N-diethyl-4-(2,2,2-trifluoroethylamino)pyridine-2-carboxamide
CID 43517418
N,N-diethyl-4-[(4-methylcyclohexyl)amino]pyridine-2-carboxamide
CID 43395286
4-(1-aminopropan-2-ylamino)-N,N-diethylpyridine-2-carboxamide
CID 55228575
methyl 2-[[2-(diethylcarbamoyl)-4-pyridinyl]amino]-3-hydroxypropanoate
CID 62006426
N,N-dimethyl-4-[(3-methylpyrrolidin-3-yl)amino]pyridine-2-carboxamide
CID 107425785
N,N-diethyl-4-(pent-4-ynylamino)pyridine-2-carboxamide
CID 106222471
4-(3-acetamidoanilino)-N,N-diethylpyridine-2-carboxamide
CID 109216443
N,N-diethyl-4-(2-methylanilino)pyridine-2-carboxamide
CID 109216389

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-4-[(1-methylcyclopropyl)amino]pyridine-2-carboxamide?
The IUPAC name of N,N-diethyl-4-[(1-methylcyclopropyl)amino]pyridine-2-carboxamide (CID 113485597) is N,N-diethyl-4-[(1-methylcyclopropyl)amino]pyridine-2-carboxamide.
What is the SMILES notation for N,N-diethyl-4-[(1-methylcyclopropyl)amino]pyridine-2-carboxamide?
The canonical SMILES for N,N-diethyl-4-[(1-methylcyclopropyl)amino]pyridine-2-carboxamide is CCN(CC)C(=O)c1cc(NC2(C)CC2)ccn1.
What is the InChIKey of N,N-diethyl-4-[(1-methylcyclopropyl)amino]pyridine-2-carboxamide?
The InChIKey is RSAHPYHRPRHZPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-4-17(5-2)13(18)12-10-11(6-9-15-12)16-14(3)7-8-14/h6,9-10H,4-5,7-8H2,1-3H3,(H,15,16).
What are the key properties of N,N-diethyl-4-[(1-methylcyclopropyl)amino]pyridine-2-carboxamide?
N,N-diethyl-4-[(1-methylcyclopropyl)amino]pyridine-2-carboxamide has a molecular weight of 247.34 g/mol, XLogP of 2.53, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-4-[(1-methylcyclopropyl)amino]pyridine-2-carboxamide is sourced from PubChem (CID 113485597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).