5-chloro-2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-carboxamide

C14H22ClN3O — CID 114922169

IUPAC5-chloro-2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-carboxamide
SMILESCCCN(C(=O)c1cc(NCC)ncc1Cl)C(C)C
InChIInChI=1S/C14H22ClN3O/c1-5-7-18(10(3)4)14(19)11-8-13(16-6-2)17-9-12(11)15/h8-10H,5-7H2,1-4H3,(H,16,17)
InChIKeyCPHZDRRVYQSMAI-UHFFFAOYSA-N
MW283.80 g/mol
LogP3.43
Rot. Bonds6

About 5-chloro-2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-carboxamide

5-chloro-2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-carboxamide (PubChem CID 114922169) has the molecular formula C14H22ClN3O and a molecular weight of 283.80 g/mol. Its IUPAC name is 5-chloro-2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-carboxamide.

Molecular Properties

Compound Name5-chloro-2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-carboxamide
PubChem CID114922169
Molecular FormulaC14H22ClN3O
Molecular Weight283.80 g/mol
Exact Mass283.15
IUPAC Name5-chloro-2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-carboxamide
SMILESCCCN(C(=O)c1cc(NCC)ncc1Cl)C(C)C
InChIInChI=1S/C14H22ClN3O/c1-5-7-18(10(3)4)14(19)11-8-13(16-6-2)17-9-12(11)15/h8-10H,5-7H2,1-4H3,(H,16,17)
InChIKeyCPHZDRRVYQSMAI-UHFFFAOYSA-N
XLogP3.43
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.80
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-N-(2-hydroxyethyl)-N-propan-2-yl-2-(propylamino)pyridine-4-carboxamide
CID 114923196
5-chloro-2-(ethylamino)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyridine-4-carboxamide
CID 114922532
5-chloro-2-(ethylamino)-N-methyl-N-propan-2-ylpyridine-4-carboxamide
CID 114921827
N,N-dibutyl-5-chloro-2-(ethylamino)pyridine-4-carboxamide
CID 114922104
5-chloro-N-[2-(dimethylamino)ethyl]-2-(ethylamino)-N-methylpyridine-4-carboxamide
CID 114923600
3-chloro-6-(ethylamino)-N-propan-2-yl-N-propylpyridine-2-carboxamide
CID 62169311
4-chloro-6-methyl-N-propan-2-yl-N-propylpyridine-3-carboxamide
CID 81225563
5-chloro-N-(2,3-dimethylbutyl)-2-(ethylamino)pyridine-4-carboxamide
CID 114923804
5-chloro-N-(2-hydroxyethyl)-N-methyl-2-(propylamino)pyridine-4-carboxamide
CID 114922484
5-chloro-N-(2-hydroxyethyl)-N-propyl-2-(propylamino)pyridine-4-carboxamide
CID 114922728
5-chloro-N-cyclopentyl-2-(ethylamino)-N-methylpyridine-4-carboxamide
CID 114922154
5-chloro-2-(methylamino)-N-(2-methylpropyl)-N-pentan-3-ylpyridine-4-carboxamide
CID 114924043

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-carboxamide?
The IUPAC name of 5-chloro-2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-carboxamide (CID 114922169) is 5-chloro-2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-carboxamide.
What is the SMILES notation for 5-chloro-2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-carboxamide?
The canonical SMILES for 5-chloro-2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-carboxamide is CCCN(C(=O)c1cc(NCC)ncc1Cl)C(C)C.
What is the InChIKey of 5-chloro-2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-carboxamide?
The InChIKey is CPHZDRRVYQSMAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22ClN3O/c1-5-7-18(10(3)4)14(19)11-8-13(16-6-2)17-9-12(11)15/h8-10H,5-7H2,1-4H3,(H,16,17).
What are the key properties of 5-chloro-2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-carboxamide?
5-chloro-2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-carboxamide has a molecular weight of 283.80 g/mol, XLogP of 3.43, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-(ethylamino)-N-propan-2-yl-N-propylpyridine-4-carboxamide is sourced from PubChem (CID 114922169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).