N-methyl-N-(1-methylpiperidin-4-yl)-2-(propylamino)pyridine-3-carboxamide

C16H26N4O — CID 62165835

IUPACN-methyl-N-(1-methylpiperidin-4-yl)-2-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ncccc1C(=O)N(C)C1CCN(C)CC1
InChIInChI=1S/C16H26N4O/c1-4-9-17-15-14(6-5-10-18-15)16(21)20(3)13-7-11-19(2)12-8-13/h5-6,10,13H,4,7-9,11-12H2,1-3H3,(H,17,18)
InChIKeyWBPQXBGEUYJGNO-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.07
Rot. Bonds5

About N-methyl-N-(1-methylpiperidin-4-yl)-2-(propylamino)pyridine-3-carboxamide

N-methyl-N-(1-methylpiperidin-4-yl)-2-(propylamino)pyridine-3-carboxamide (PubChem CID 62165835) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is N-methyl-N-(1-methylpiperidin-4-yl)-2-(propylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(1-methylpiperidin-4-yl)-2-(propylamino)pyridine-3-carboxamide
PubChem CID62165835
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC NameN-methyl-N-(1-methylpiperidin-4-yl)-2-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ncccc1C(=O)N(C)C1CCN(C)CC1
InChIInChI=1S/C16H26N4O/c1-4-9-17-15-14(6-5-10-18-15)16(21)20(3)13-7-11-19(2)12-8-13/h5-6,10,13H,4,7-9,11-12H2,1-3H3,(H,17,18)
InChIKeyWBPQXBGEUYJGNO-UHFFFAOYSA-N
XLogP2.07
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(cyclopropylmethyl)-N-ethyl-2-(propylamino)pyridine-3-carboxamide
CID 63940110
2-(ethylamino)-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]pyridine-3-carboxamide
CID 63275138
N-cyclopropyl-N-methyl-2-(propylamino)benzamide
CID 62169629
2-(azepan-1-yl)-N-methyl-N-(1-methylpiperidin-4-yl)pyridine-3-carboxamide
CID 84576935
N-methyl-N-(2-methylbutan-2-yl)-2-(propylamino)pyridine-3-carboxamide
CID 63961871
N-butyl-N-methyl-2-(propylamino)pyridine-3-carboxamide
CID 62186071
N-methyl-N-(3-methylbutan-2-yl)-2-(propylamino)pyridine-3-carboxamide
CID 62168547
2-chloro-N-methyl-N-(1-propylpiperidin-4-yl)pyridine-3-carboxamide
CID 61051848
N-methyl-N-(1-methylpiperidin-4-yl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide
CID 110475007
N-(cyclopentylmethyl)-2-(propylamino)pyridine-3-carboxamide
CID 62168476
N-(2-chloro-3-pyridinyl)-N-methyl-2-(propylamino)pyridine-3-carboxamide
CID 19960025
2-(propylamino)pyridine-3-carboxylate
CID 22068597

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1-methylpiperidin-4-yl)-2-(propylamino)pyridine-3-carboxamide?
The IUPAC name of N-methyl-N-(1-methylpiperidin-4-yl)-2-(propylamino)pyridine-3-carboxamide (CID 62165835) is N-methyl-N-(1-methylpiperidin-4-yl)-2-(propylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-methyl-N-(1-methylpiperidin-4-yl)-2-(propylamino)pyridine-3-carboxamide?
The canonical SMILES for N-methyl-N-(1-methylpiperidin-4-yl)-2-(propylamino)pyridine-3-carboxamide is CCCNc1ncccc1C(=O)N(C)C1CCN(C)CC1.
What is the InChIKey of N-methyl-N-(1-methylpiperidin-4-yl)-2-(propylamino)pyridine-3-carboxamide?
The InChIKey is WBPQXBGEUYJGNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-4-9-17-15-14(6-5-10-18-15)16(21)20(3)13-7-11-19(2)12-8-13/h5-6,10,13H,4,7-9,11-12H2,1-3H3,(H,17,18).
What are the key properties of N-methyl-N-(1-methylpiperidin-4-yl)-2-(propylamino)pyridine-3-carboxamide?
N-methyl-N-(1-methylpiperidin-4-yl)-2-(propylamino)pyridine-3-carboxamide has a molecular weight of 290.41 g/mol, XLogP of 2.07, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1-methylpiperidin-4-yl)-2-(propylamino)pyridine-3-carboxamide is sourced from PubChem (CID 62165835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).