6-amino-5-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide

C12H16ClN3O — CID 62156018

IUPAC6-amino-5-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide
SMILESCC(C1CC1)N(C)C(=O)c1cnc(N)c(Cl)c1
InChIInChI=1S/C12H16ClN3O/c1-7(8-3-4-8)16(2)12(17)9-5-10(13)11(14)15-6-9/h5-8H,3-4H2,1-2H3,(H2,14,15)
InChIKeyGMWXCBQMTIMEDM-UHFFFAOYSA-N
MW253.73 g/mol
LogP2.19
Rot. Bonds3

About 6-amino-5-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide

6-amino-5-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide (PubChem CID 62156018) has the molecular formula C12H16ClN3O and a molecular weight of 253.73 g/mol. Its IUPAC name is 6-amino-5-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-amino-5-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide
PubChem CID62156018
Molecular FormulaC12H16ClN3O
Molecular Weight253.73 g/mol
Exact Mass253.10
IUPAC Name6-amino-5-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide
SMILESCC(C1CC1)N(C)C(=O)c1cnc(N)c(Cl)c1
InChIInChI=1S/C12H16ClN3O/c1-7(8-3-4-8)16(2)12(17)9-5-10(13)11(14)15-6-9/h5-8H,3-4H2,1-2H3,(H2,14,15)
InChIKeyGMWXCBQMTIMEDM-UHFFFAOYSA-N
XLogP2.19
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.73
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-amino-5-chloro-N-cyclopropyl-N-ethylpyridine-3-carboxamide
CID 62155621
6-amino-5-chloro-N-[1-(3-chlorophenyl)ethyl]-N-methylpyridine-3-carboxamide
CID 62728769
4-amino-N-(1-cyclopropylethyl)-3-hydroxy-N-methylbenzamide
CID 107074108
6-amino-5-chloro-N-(2-methylpropyl)-N-propan-2-ylpyridine-3-carboxamide
CID 62185664
6-amino-5-chloro-N-methyl-N-(oxan-4-ylmethyl)pyridine-3-carboxamide
CID 63707112
N-(1-cyclopropylethyl)-N-methyl-6-propan-2-yloxypyridine-3-carboxamide
CID 75414813
5-bromo-2-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide
CID 62001192
2-chloro-N-(1-cyclopropylethyl)-5-fluoro-N-methylpyridine-3-carboxamide
CID 103891975
3-amino-N-(1-cyclopropylethyl)-4-fluoro-N-methylbenzamide
CID 43568628
2-bromo-N-(1-cyclopropylethyl)-N-methylpyridine-4-carboxamide
CID 103752379
4-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-2-carboxamide
CID 43420571
6-amino-5-chloro-N-[2-[cyclopropyl(methyl)amino]ethyl]pyridine-3-carboxamide
CID 62728599

Frequently Asked Questions

What is the IUPAC name of 6-amino-5-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide?
The IUPAC name of 6-amino-5-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide (CID 62156018) is 6-amino-5-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide.
What is the SMILES notation for 6-amino-5-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide?
The canonical SMILES for 6-amino-5-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide is CC(C1CC1)N(C)C(=O)c1cnc(N)c(Cl)c1.
What is the InChIKey of 6-amino-5-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide?
The InChIKey is GMWXCBQMTIMEDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16ClN3O/c1-7(8-3-4-8)16(2)12(17)9-5-10(13)11(14)15-6-9/h5-8H,3-4H2,1-2H3,(H2,14,15).
What are the key properties of 6-amino-5-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide?
6-amino-5-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide has a molecular weight of 253.73 g/mol, XLogP of 2.19, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-5-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide is sourced from PubChem (CID 62156018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).