N-[6-(propylamino)-3-pyridinyl]cyclopropanecarboxamide

C12H17N3O — CID 113009028

IUPACN-[6-(propylamino)-3-pyridinyl]cyclopropanecarboxamide
SMILESCCCNc1ccc(NC(=O)C2CC2)cn1
InChIInChI=1S/C12H17N3O/c1-2-7-13-11-6-5-10(8-14-11)15-12(16)9-3-4-9/h5-6,8-9H,2-4,7H2,1H3,(H,13,14)(H,15,16)
InChIKeyJTZNLTIQFJJPKW-UHFFFAOYSA-N
MW219.29 g/mol
LogP2.25
Rot. Bonds5

About N-[6-(propylamino)-3-pyridinyl]cyclopropanecarboxamide

N-[6-(propylamino)-3-pyridinyl]cyclopropanecarboxamide (PubChem CID 113009028) has the molecular formula C12H17N3O and a molecular weight of 219.29 g/mol. Its IUPAC name is N-[6-(propylamino)-3-pyridinyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[6-(propylamino)-3-pyridinyl]cyclopropanecarboxamide
PubChem CID113009028
Molecular FormulaC12H17N3O
Molecular Weight219.29 g/mol
Exact Mass219.14
IUPAC NameN-[6-(propylamino)-3-pyridinyl]cyclopropanecarboxamide
SMILESCCCNc1ccc(NC(=O)C2CC2)cn1
InChIInChI=1S/C12H17N3O/c1-2-7-13-11-6-5-10(8-14-11)15-12(16)9-3-4-9/h5-6,8-9H,2-4,7H2,1H3,(H,13,14)(H,15,16)
InChIKeyJTZNLTIQFJJPKW-UHFFFAOYSA-N
XLogP2.25
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[6-(2-methoxyethylamino)-3-pyridinyl]cyclopropanecarboxamide
CID 113010317
N-[6-[2-(dimethylamino)ethylamino]-3-pyridinyl]cyclobutanecarboxamide
CID 113010772
N-[6-(2-methoxyethylamino)-3-pyridinyl]cyclohexanecarboxamide
CID 113010320
N-[6-(3-methylbutylamino)-3-pyridinyl]cyclohexanecarboxamide
CID 113015064
N-[5-(butylamino)-2-pyridinyl]cyclobutanecarboxamide
CID 113024024
N-[6-[(2-methylphenyl)methylamino]-3-pyridinyl]cyclopropanecarboxamide
CID 113011542
N-[5-(butylamino)-2-pyridinyl]cyclohexanecarboxamide
CID 113023958
N-[6-(butanoylamino)-3-pyridinyl]cyclohexanecarboxamide
CID 1452761
N-[5-[(2-amino-2-methylpentanoyl)amino]-2-pyridinyl]cyclopropanecarboxamide
CID 119879412
N-[5-(propylamino)-2-pyridinyl]propanamide
CID 113023412
1-phenyl-3-[6-(propylamino)-3-pyridinyl]urea
CID 113009091
2-ethyl-N-[6-(propylamino)-3-pyridinyl]butanamide
CID 113009034

Frequently Asked Questions

What is the IUPAC name of N-[6-(propylamino)-3-pyridinyl]cyclopropanecarboxamide?
The IUPAC name of N-[6-(propylamino)-3-pyridinyl]cyclopropanecarboxamide (CID 113009028) is N-[6-(propylamino)-3-pyridinyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[6-(propylamino)-3-pyridinyl]cyclopropanecarboxamide?
The canonical SMILES for N-[6-(propylamino)-3-pyridinyl]cyclopropanecarboxamide is CCCNc1ccc(NC(=O)C2CC2)cn1.
What is the InChIKey of N-[6-(propylamino)-3-pyridinyl]cyclopropanecarboxamide?
The InChIKey is JTZNLTIQFJJPKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O/c1-2-7-13-11-6-5-10(8-14-11)15-12(16)9-3-4-9/h5-6,8-9H,2-4,7H2,1H3,(H,13,14)(H,15,16).
What are the key properties of N-[6-(propylamino)-3-pyridinyl]cyclopropanecarboxamide?
N-[6-(propylamino)-3-pyridinyl]cyclopropanecarboxamide has a molecular weight of 219.29 g/mol, XLogP of 2.25, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(propylamino)-3-pyridinyl]cyclopropanecarboxamide is sourced from PubChem (CID 113009028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).