6-amino-3-chloro-N-ethyl-N-(2-methylpropyl)pyridine-2-carboxamide

C12H18ClN3O — CID 62153910

IUPAC6-amino-3-chloro-N-ethyl-N-(2-methylpropyl)pyridine-2-carboxamide
SMILESCCN(CC(C)C)C(=O)c1nc(N)ccc1Cl
InChIInChI=1S/C12H18ClN3O/c1-4-16(7-8(2)3)12(17)11-9(13)5-6-10(14)15-11/h5-6,8H,4,7H2,1-3H3,(H2,14,15)
InChIKeyFJHUGHIYRSLQHS-UHFFFAOYSA-N
MW255.75 g/mol
LogP2.44
Rot. Bonds4

About 6-amino-3-chloro-N-ethyl-N-(2-methylpropyl)pyridine-2-carboxamide

6-amino-3-chloro-N-ethyl-N-(2-methylpropyl)pyridine-2-carboxamide (PubChem CID 62153910) has the molecular formula C12H18ClN3O and a molecular weight of 255.75 g/mol. Its IUPAC name is 6-amino-3-chloro-N-ethyl-N-(2-methylpropyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-amino-3-chloro-N-ethyl-N-(2-methylpropyl)pyridine-2-carboxamide
PubChem CID62153910
Molecular FormulaC12H18ClN3O
Molecular Weight255.75 g/mol
Exact Mass255.11
IUPAC Name6-amino-3-chloro-N-ethyl-N-(2-methylpropyl)pyridine-2-carboxamide
SMILESCCN(CC(C)C)C(=O)c1nc(N)ccc1Cl
InChIInChI=1S/C12H18ClN3O/c1-4-16(7-8(2)3)12(17)11-9(13)5-6-10(14)15-11/h5-6,8H,4,7H2,1-3H3,(H2,14,15)
InChIKeyFJHUGHIYRSLQHS-UHFFFAOYSA-N
XLogP2.44
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.75
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-amino-3-chloro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide
CID 62161041
6-amino-N-butan-2-yl-3-chloro-N-ethylpyridine-2-carboxamide
CID 62154764
3,6-dichloro-N,N-bis(2-methylpropyl)pyridine-2-carboxamide
CID 60748160
6-amino-3-chloro-N-ethyl-N-methylpyridine-2-carboxamide
CID 62154422
6-amino-N,N-dibutyl-3-chloropyridine-2-carboxamide
CID 55042068
6-amino-3-chloro-N-[2-(dimethylamino)ethyl]-N-propylpyridine-2-carboxamide
CID 62161613
6-amino-3-chloro-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridine-2-carboxamide
CID 112664231
6-amino-3-chloro-N-(2-methylpropyl)pyridine-2-carboxamide
CID 62156560
6-amino-3-chloro-N,N-bis(2-methoxyethyl)pyridine-2-carboxamide
CID 55042057
6-amino-3-chloro-N-(2-hydroxyethyl)-N-propan-2-ylpyridine-2-carboxamide
CID 62186020
6-amino-3-chloro-N-[1-(diethylamino)propan-2-yl]pyridine-2-carboxamide
CID 62161278
6-amino-3-chloro-N-ethylpyridine-2-carboxamide
CID 62154853

Frequently Asked Questions

What is the IUPAC name of 6-amino-3-chloro-N-ethyl-N-(2-methylpropyl)pyridine-2-carboxamide?
The IUPAC name of 6-amino-3-chloro-N-ethyl-N-(2-methylpropyl)pyridine-2-carboxamide (CID 62153910) is 6-amino-3-chloro-N-ethyl-N-(2-methylpropyl)pyridine-2-carboxamide.
What is the SMILES notation for 6-amino-3-chloro-N-ethyl-N-(2-methylpropyl)pyridine-2-carboxamide?
The canonical SMILES for 6-amino-3-chloro-N-ethyl-N-(2-methylpropyl)pyridine-2-carboxamide is CCN(CC(C)C)C(=O)c1nc(N)ccc1Cl.
What is the InChIKey of 6-amino-3-chloro-N-ethyl-N-(2-methylpropyl)pyridine-2-carboxamide?
The InChIKey is FJHUGHIYRSLQHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18ClN3O/c1-4-16(7-8(2)3)12(17)11-9(13)5-6-10(14)15-11/h5-6,8H,4,7H2,1-3H3,(H2,14,15).
What are the key properties of 6-amino-3-chloro-N-ethyl-N-(2-methylpropyl)pyridine-2-carboxamide?
6-amino-3-chloro-N-ethyl-N-(2-methylpropyl)pyridine-2-carboxamide has a molecular weight of 255.75 g/mol, XLogP of 2.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-3-chloro-N-ethyl-N-(2-methylpropyl)pyridine-2-carboxamide is sourced from PubChem (CID 62153910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).