N-[(1-methylpiperidin-2-yl)methyl]-6-(propylamino)pyridine-3-carboxamide

C16H26N4O — CID 62173667

IUPACN-[(1-methylpiperidin-2-yl)methyl]-6-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ccc(C(=O)NCC2CCCCN2C)cn1
InChIInChI=1S/C16H26N4O/c1-3-9-17-15-8-7-13(11-18-15)16(21)19-12-14-6-4-5-10-20(14)2/h7-8,11,14H,3-6,9-10,12H2,1-2H3,(H,17,18)(H,19,21)
InChIKeyYGPQJGWYHIJCQJ-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.12
Rot. Bonds6

About N-[(1-methylpiperidin-2-yl)methyl]-6-(propylamino)pyridine-3-carboxamide

N-[(1-methylpiperidin-2-yl)methyl]-6-(propylamino)pyridine-3-carboxamide (PubChem CID 62173667) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is N-[(1-methylpiperidin-2-yl)methyl]-6-(propylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(1-methylpiperidin-2-yl)methyl]-6-(propylamino)pyridine-3-carboxamide
PubChem CID62173667
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC NameN-[(1-methylpiperidin-2-yl)methyl]-6-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ccc(C(=O)NCC2CCCCN2C)cn1
InChIInChI=1S/C16H26N4O/c1-3-9-17-15-8-7-13(11-18-15)16(21)19-12-14-6-4-5-10-20(14)2/h7-8,11,14H,3-6,9-10,12H2,1-2H3,(H,17,18)(H,19,21)
InChIKeyYGPQJGWYHIJCQJ-UHFFFAOYSA-N
XLogP2.12
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-(ethylamino)-N-[2-[(2S)-1-methylpiperidin-2-yl]ethyl]pyridine-3-carboxamide
CID 25374156
N-(cyclobutylmethyl)-6-(propylamino)pyridine-3-carboxamide
CID 62168464
N-[(1-methylpiperidin-2-yl)methyl]-4-(propylamino)pyridine-3-carboxamide
CID 81238615
N-[(1-ethylpyrrolidin-2-yl)methyl]-6-(methylamino)pyridine-3-carboxamide
CID 62165372
[6-(propylamino)-3-pyridinyl]-pyrrolidin-1-ylmethanone
CID 60722911
azepan-1-yl-[6-(propylamino)-3-pyridinyl]methanone
CID 62172577
6-[2-[(2-cyclopentylacetyl)amino]ethylamino]-N-propylpyridine-3-carboxamide
CID 71876136
6-[(2-hydroxycyclopentyl)methylamino]-N-propylpyridine-3-carboxamide
CID 133324037
N-(1,4-dioxan-2-ylmethyl)-6-(propylamino)pyridine-3-carboxamide
CID 62181314
N-methyl-6-(propylamino)-N-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide
CID 63208830
6-(imidazo[1,2-a]pyridin-3-ylmethylamino)-N-[2-(1-methylpiperidin-2-yl)ethyl]pyridine-3-carboxamide
CID 45199193
N-methyl-N-(1-methylpiperidin-3-yl)-6-(propylamino)pyridine-3-carboxamide
CID 62540530

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylpiperidin-2-yl)methyl]-6-(propylamino)pyridine-3-carboxamide?
The IUPAC name of N-[(1-methylpiperidin-2-yl)methyl]-6-(propylamino)pyridine-3-carboxamide (CID 62173667) is N-[(1-methylpiperidin-2-yl)methyl]-6-(propylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-[(1-methylpiperidin-2-yl)methyl]-6-(propylamino)pyridine-3-carboxamide?
The canonical SMILES for N-[(1-methylpiperidin-2-yl)methyl]-6-(propylamino)pyridine-3-carboxamide is CCCNc1ccc(C(=O)NCC2CCCCN2C)cn1.
What is the InChIKey of N-[(1-methylpiperidin-2-yl)methyl]-6-(propylamino)pyridine-3-carboxamide?
The InChIKey is YGPQJGWYHIJCQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-3-9-17-15-8-7-13(11-18-15)16(21)19-12-14-6-4-5-10-20(14)2/h7-8,11,14H,3-6,9-10,12H2,1-2H3,(H,17,18)(H,19,21).
What are the key properties of N-[(1-methylpiperidin-2-yl)methyl]-6-(propylamino)pyridine-3-carboxamide?
N-[(1-methylpiperidin-2-yl)methyl]-6-(propylamino)pyridine-3-carboxamide has a molecular weight of 290.41 g/mol, XLogP of 2.12, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylpiperidin-2-yl)methyl]-6-(propylamino)pyridine-3-carboxamide is sourced from PubChem (CID 62173667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).