2-amino-N-(cyclobutylmethyl)-N-ethyl-6-propan-2-ylpyridine-4-carboxamide

C16H25N3O — CID 107401363

IUPAC2-amino-N-(cyclobutylmethyl)-N-ethyl-6-propan-2-ylpyridine-4-carboxamide
SMILESCCN(CC1CCC1)C(=O)c1cc(N)nc(C(C)C)c1
InChIInChI=1S/C16H25N3O/c1-4-19(10-12-6-5-7-12)16(20)13-8-14(11(2)3)18-15(17)9-13/h8-9,11-12H,4-7,10H2,1-3H3,(H2,17,18)
InChIKeyMQFRSIOHFJBZOA-UHFFFAOYSA-N
MW275.40 g/mol
LogP3.05
Rot. Bonds5

About 2-amino-N-(cyclobutylmethyl)-N-ethyl-6-propan-2-ylpyridine-4-carboxamide

2-amino-N-(cyclobutylmethyl)-N-ethyl-6-propan-2-ylpyridine-4-carboxamide (PubChem CID 107401363) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is 2-amino-N-(cyclobutylmethyl)-N-ethyl-6-propan-2-ylpyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-(cyclobutylmethyl)-N-ethyl-6-propan-2-ylpyridine-4-carboxamide
PubChem CID107401363
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC Name2-amino-N-(cyclobutylmethyl)-N-ethyl-6-propan-2-ylpyridine-4-carboxamide
SMILESCCN(CC1CCC1)C(=O)c1cc(N)nc(C(C)C)c1
InChIInChI=1S/C16H25N3O/c1-4-19(10-12-6-5-7-12)16(20)13-8-14(11(2)3)18-15(17)9-13/h8-9,11-12H,4-7,10H2,1-3H3,(H2,17,18)
InChIKeyMQFRSIOHFJBZOA-UHFFFAOYSA-N
XLogP3.05
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(cyclobutylmethyl)-6-ethyl-N-methylpyridine-4-carboxamide
CID 113381050
2-amino-N-(cyclopropylmethyl)-N-ethylpyridine-4-carboxamide
CID 63939345
2-amino-6-chloro-N-(cyclopropylmethyl)-N-propylpyridine-4-carboxamide
CID 55041470
N-(cyclobutylmethyl)-N-ethyl-3,4-dihydroxybenzamide
CID 107728572
3-chloro-N-(cyclobutylmethyl)-N-ethyl-5-sulfamoylbenzamide
CID 107400421
3-bromo-N-(cyclobutylmethyl)-N-ethyl-5-sulfamoylbenzamide
CID 107400412
4-amino-3-chloro-N-(cyclobutylmethyl)-N-ethyl-5-nitrobenzamide
CID 107401352
4-amino-N-(cyclobutylmethyl)-N-ethyl-2-(propan-2-ylamino)-1,3-thiazole-5-carboxamide
CID 107403247
4-amino-N-(cyclopropylmethyl)-N-ethylbenzamide
CID 63956122
N-(cyclopropylmethyl)-N-ethyl-3,4,5-trifluorobenzamide
CID 63954344
4-(chloromethyl)-N-(cyclobutylmethyl)-N-ethylbenzamide
CID 107397605
6-amino-N-(cyclopropylmethyl)-N-ethylpyridine-2-carboxamide
CID 63940117

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(cyclobutylmethyl)-N-ethyl-6-propan-2-ylpyridine-4-carboxamide?
The IUPAC name of 2-amino-N-(cyclobutylmethyl)-N-ethyl-6-propan-2-ylpyridine-4-carboxamide (CID 107401363) is 2-amino-N-(cyclobutylmethyl)-N-ethyl-6-propan-2-ylpyridine-4-carboxamide.
What is the SMILES notation for 2-amino-N-(cyclobutylmethyl)-N-ethyl-6-propan-2-ylpyridine-4-carboxamide?
The canonical SMILES for 2-amino-N-(cyclobutylmethyl)-N-ethyl-6-propan-2-ylpyridine-4-carboxamide is CCN(CC1CCC1)C(=O)c1cc(N)nc(C(C)C)c1.
What is the InChIKey of 2-amino-N-(cyclobutylmethyl)-N-ethyl-6-propan-2-ylpyridine-4-carboxamide?
The InChIKey is MQFRSIOHFJBZOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-4-19(10-12-6-5-7-12)16(20)13-8-14(11(2)3)18-15(17)9-13/h8-9,11-12H,4-7,10H2,1-3H3,(H2,17,18).
What are the key properties of 2-amino-N-(cyclobutylmethyl)-N-ethyl-6-propan-2-ylpyridine-4-carboxamide?
2-amino-N-(cyclobutylmethyl)-N-ethyl-6-propan-2-ylpyridine-4-carboxamide has a molecular weight of 275.40 g/mol, XLogP of 3.05, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(cyclobutylmethyl)-N-ethyl-6-propan-2-ylpyridine-4-carboxamide is sourced from PubChem (CID 107401363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).