N-butan-2-yl-N-butyl-6-(ethylamino)pyridine-2-carboxamide

C16H27N3O — CID 62234511

IUPACN-butan-2-yl-N-butyl-6-(ethylamino)pyridine-2-carboxamide
SMILESCCCCN(C(=O)c1cccc(NCC)n1)C(C)CC
InChIInChI=1S/C16H27N3O/c1-5-8-12-19(13(4)6-2)16(20)14-10-9-11-15(18-14)17-7-3/h9-11,13H,5-8,12H2,1-4H3,(H,17,18)
InChIKeyYCKPJUSXCLIGGE-UHFFFAOYSA-N
MW277.41 g/mol
LogP3.55
Rot. Bonds8

About N-butan-2-yl-N-butyl-6-(ethylamino)pyridine-2-carboxamide

N-butan-2-yl-N-butyl-6-(ethylamino)pyridine-2-carboxamide (PubChem CID 62234511) has the molecular formula C16H27N3O and a molecular weight of 277.41 g/mol. Its IUPAC name is N-butan-2-yl-N-butyl-6-(ethylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-butan-2-yl-N-butyl-6-(ethylamino)pyridine-2-carboxamide
PubChem CID62234511
Molecular FormulaC16H27N3O
Molecular Weight277.41 g/mol
Exact Mass277.22
IUPAC NameN-butan-2-yl-N-butyl-6-(ethylamino)pyridine-2-carboxamide
SMILESCCCCN(C(=O)c1cccc(NCC)n1)C(C)CC
InChIInChI=1S/C16H27N3O/c1-5-8-12-19(13(4)6-2)16(20)14-10-9-11-15(18-14)17-7-3/h9-11,13H,5-8,12H2,1-4H3,(H,17,18)
InChIKeyYCKPJUSXCLIGGE-UHFFFAOYSA-N
XLogP3.55
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dibutyl-6-(ethylamino)pyridine-2-carboxamide
CID 62240821
N-butan-2-yl-N-butyl-3-chloro-6-(ethylamino)pyridine-2-carboxamide
CID 62176971
N-[3-(dimethylamino)propyl]-6-(ethylamino)-N-methylpyridine-2-carboxamide
CID 63727068
N-butan-2-yl-6-hydrazinyl-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 55050644
N-butan-2-yl-N-butyl-2,6-dihydroxybenzamide
CID 107689251
6-(ethylamino)-N-propan-2-yl-N-(thiophen-2-ylmethyl)pyridine-2-carboxamide
CID 62240687
6-amino-N-butan-2-yl-N-butylpyridazine-3-carboxamide
CID 62186029
N-butan-2-yl-N-butyl-4-(ethylamino)pyridine-3-carboxamide
CID 81240030
N-butan-2-yl-N-butyl-2H-triazole-4-carboxamide
CID 78954217
5-bromo-N-butan-2-yl-N-butylpyridine-2-carboxamide
CID 62953059
1-[6-(pentylamino)-2-pyridinyl]ethanone
CID 68551808
N-[1-(dimethylamino)propan-2-yl]-6-(ethylamino)pyridine-2-carboxamide
CID 82949517

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-N-butyl-6-(ethylamino)pyridine-2-carboxamide?
The IUPAC name of N-butan-2-yl-N-butyl-6-(ethylamino)pyridine-2-carboxamide (CID 62234511) is N-butan-2-yl-N-butyl-6-(ethylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-butan-2-yl-N-butyl-6-(ethylamino)pyridine-2-carboxamide?
The canonical SMILES for N-butan-2-yl-N-butyl-6-(ethylamino)pyridine-2-carboxamide is CCCCN(C(=O)c1cccc(NCC)n1)C(C)CC.
What is the InChIKey of N-butan-2-yl-N-butyl-6-(ethylamino)pyridine-2-carboxamide?
The InChIKey is YCKPJUSXCLIGGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O/c1-5-8-12-19(13(4)6-2)16(20)14-10-9-11-15(18-14)17-7-3/h9-11,13H,5-8,12H2,1-4H3,(H,17,18).
What are the key properties of N-butan-2-yl-N-butyl-6-(ethylamino)pyridine-2-carboxamide?
N-butan-2-yl-N-butyl-6-(ethylamino)pyridine-2-carboxamide has a molecular weight of 277.41 g/mol, XLogP of 3.55, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-N-butyl-6-(ethylamino)pyridine-2-carboxamide is sourced from PubChem (CID 62234511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).