N-(3-hydroxypropyl)-N-propan-2-yl-6-(propylamino)pyridine-3-carboxamide

C15H25N3O2 — CID 62177310

IUPACN-(3-hydroxypropyl)-N-propan-2-yl-6-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ccc(C(=O)N(CCCO)C(C)C)cn1
InChIInChI=1S/C15H25N3O2/c1-4-8-16-14-7-6-13(11-17-14)15(20)18(12(2)3)9-5-10-19/h6-7,11-12,19H,4-5,8-10H2,1-3H3,(H,16,17)
InChIKeyBLKCWGXSJDHGIY-UHFFFAOYSA-N
MW279.38 g/mol
LogP2.14
Rot. Bonds8

About N-(3-hydroxypropyl)-N-propan-2-yl-6-(propylamino)pyridine-3-carboxamide

N-(3-hydroxypropyl)-N-propan-2-yl-6-(propylamino)pyridine-3-carboxamide (PubChem CID 62177310) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is N-(3-hydroxypropyl)-N-propan-2-yl-6-(propylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-hydroxypropyl)-N-propan-2-yl-6-(propylamino)pyridine-3-carboxamide
PubChem CID62177310
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC NameN-(3-hydroxypropyl)-N-propan-2-yl-6-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ccc(C(=O)N(CCCO)C(C)C)cn1
InChIInChI=1S/C15H25N3O2/c1-4-8-16-14-7-6-13(11-17-14)15(20)18(12(2)3)9-5-10-19/h6-7,11-12,19H,4-5,8-10H2,1-3H3,(H,16,17)
InChIKeyBLKCWGXSJDHGIY-UHFFFAOYSA-N
XLogP2.14
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-propan-2-yl-N-propyl-6-(propylamino)pyridine-3-carboxamide
CID 62168280
N-(cyclopropylmethyl)-N-propan-2-yl-6-(propylamino)pyridine-3-carboxamide
CID 62178134
N-(2-hydroxyethyl)-N-methyl-6-(propylamino)pyridine-3-carboxamide
CID 55046985
N-(2-hydroxyethyl)-N-propyl-6-(propylamino)pyridine-3-carboxamide
CID 55046804
N-benzyl-6-(pentylamino)-N-propan-2-ylpyridine-3-carboxamide
CID 109161120
5-chloro-N-(2-hydroxyethyl)-N-propan-2-yl-2-(propylamino)pyridine-4-carboxamide
CID 114923196
6-(6-hydroxyhexylamino)-N,N-dimethylpyridine-3-carboxamide
CID 103918113
4-butoxy-N-(3-hydroxypropyl)-N-propan-2-ylbenzamide
CID 61040169
N-benzyl-6-(2-phenylethylamino)-N-propan-2-ylpyridine-3-carboxamide
CID 109158221
6-chloro-N-pentyl-N-propan-2-ylpyridine-3-carboxamide
CID 60746433
N-butyl-6-[3-(dimethylamino)propylamino]-N-methylpyridine-3-carboxamide
CID 109154268
N-(2-methylbutyl)-6-(propylamino)pyridine-3-carboxamide
CID 62693585

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxypropyl)-N-propan-2-yl-6-(propylamino)pyridine-3-carboxamide?
The IUPAC name of N-(3-hydroxypropyl)-N-propan-2-yl-6-(propylamino)pyridine-3-carboxamide (CID 62177310) is N-(3-hydroxypropyl)-N-propan-2-yl-6-(propylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(3-hydroxypropyl)-N-propan-2-yl-6-(propylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(3-hydroxypropyl)-N-propan-2-yl-6-(propylamino)pyridine-3-carboxamide is CCCNc1ccc(C(=O)N(CCCO)C(C)C)cn1.
What is the InChIKey of N-(3-hydroxypropyl)-N-propan-2-yl-6-(propylamino)pyridine-3-carboxamide?
The InChIKey is BLKCWGXSJDHGIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-4-8-16-14-7-6-13(11-17-14)15(20)18(12(2)3)9-5-10-19/h6-7,11-12,19H,4-5,8-10H2,1-3H3,(H,16,17).
What are the key properties of N-(3-hydroxypropyl)-N-propan-2-yl-6-(propylamino)pyridine-3-carboxamide?
N-(3-hydroxypropyl)-N-propan-2-yl-6-(propylamino)pyridine-3-carboxamide has a molecular weight of 279.38 g/mol, XLogP of 2.14, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxypropyl)-N-propan-2-yl-6-(propylamino)pyridine-3-carboxamide is sourced from PubChem (CID 62177310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).