4-amino-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide

C12H17N3O — CID 81242644

IUPAC4-amino-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide
SMILESCC(C1CC1)N(C)C(=O)c1cnccc1N
InChIInChI=1S/C12H17N3O/c1-8(9-3-4-9)15(2)12(16)10-7-14-6-5-11(10)13/h5-9H,3-4H2,1-2H3,(H2,13,14)
InChIKeyGGPZMQZTVGBNPC-UHFFFAOYSA-N
MW219.29 g/mol
LogP1.53
Rot. Bonds3

About 4-amino-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide

4-amino-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide (PubChem CID 81242644) has the molecular formula C12H17N3O and a molecular weight of 219.29 g/mol. Its IUPAC name is 4-amino-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide
PubChem CID81242644
Molecular FormulaC12H17N3O
Molecular Weight219.29 g/mol
Exact Mass219.14
IUPAC Name4-amino-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide
SMILESCC(C1CC1)N(C)C(=O)c1cnccc1N
InChIInChI=1S/C12H17N3O/c1-8(9-3-4-9)15(2)12(16)10-7-14-6-5-11(10)13/h5-9H,3-4H2,1-2H3,(H2,13,14)
InChIKeyGGPZMQZTVGBNPC-UHFFFAOYSA-N
XLogP1.53
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-(1-hydroxypropan-2-yl)-N-methylpyridine-3-carboxamide
CID 104554326
3-amino-2-bromo-N-(1-cyclopropylethyl)-N-methylbenzamide
CID 113366949
3-[4-[1-cyclopropylethyl(methyl)carbamoyl]-3-pyridinyl]prop-2-enoic acid
CID 77135159
2-bromo-N-(1-cyclopropylethyl)-N-methylbenzamide
CID 43420538
3-amino-N-(1-cyclopropylethyl)-2,5-difluoro-N-methylbenzamide
CID 107120546
4-amino-N-cyclopentyl-N-ethylpyridine-3-carboxamide
CID 81242271
4-amino-N-(2-methylpropyl)-N-propan-2-ylpyridine-3-carboxamide
CID 81240604
N-(1-cyclopropylethyl)-N-methyl-2-(methylamino)benzamide
CID 61375904
4-chloro-N-(1-cyclopropylethyl)-2-hydroxy-N-methylbenzamide
CID 43420563
4-amino-N-(1-cyclopropylethyl)-3-hydroxy-N-methylbenzamide
CID 107074108
5-amino-N-(1-cyclopropylethyl)-N-methylthieno[2,3-c]pyridazine-6-carboxamide
CID 80519309
5-bromo-2-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide
CID 62001192

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide?
The IUPAC name of 4-amino-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide (CID 81242644) is 4-amino-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide.
What is the SMILES notation for 4-amino-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide?
The canonical SMILES for 4-amino-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide is CC(C1CC1)N(C)C(=O)c1cnccc1N.
What is the InChIKey of 4-amino-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide?
The InChIKey is GGPZMQZTVGBNPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O/c1-8(9-3-4-9)15(2)12(16)10-7-14-6-5-11(10)13/h5-9H,3-4H2,1-2H3,(H2,13,14).
What are the key properties of 4-amino-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide?
4-amino-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide has a molecular weight of 219.29 g/mol, XLogP of 1.53, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide is sourced from PubChem (CID 81242644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).