4-[(1-methylpiperidin-4-yl)amino]pyridine-2-carboxamide

C12H18N4O — CID 43517657

IUPAC4-[(1-methylpiperidin-4-yl)amino]pyridine-2-carboxamide
SMILESCN1CCC(Nc2ccnc(C(N)=O)c2)CC1
InChIInChI=1S/C12H18N4O/c1-16-6-3-9(4-7-16)15-10-2-5-14-11(8-10)12(13)17/h2,5,8-9H,3-4,6-7H2,1H3,(H2,13,17)(H,14,15)
InChIKeyMWWZZGHQGJBYOH-UHFFFAOYSA-N
MW234.30 g/mol
LogP0.69
Rot. Bonds3

About 4-[(1-methylpiperidin-4-yl)amino]pyridine-2-carboxamide

4-[(1-methylpiperidin-4-yl)amino]pyridine-2-carboxamide (PubChem CID 43517657) has the molecular formula C12H18N4O and a molecular weight of 234.30 g/mol. Its IUPAC name is 4-[(1-methylpiperidin-4-yl)amino]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-[(1-methylpiperidin-4-yl)amino]pyridine-2-carboxamide
PubChem CID43517657
Molecular FormulaC12H18N4O
Molecular Weight234.30 g/mol
Exact Mass234.15
IUPAC Name4-[(1-methylpiperidin-4-yl)amino]pyridine-2-carboxamide
SMILESCN1CCC(Nc2ccnc(C(N)=O)c2)CC1
InChIInChI=1S/C12H18N4O/c1-16-6-3-9(4-7-16)15-10-2-5-14-11(8-10)12(13)17/h2,5,8-9H,3-4,6-7H2,1H3,(H2,13,17)(H,14,15)
InChIKeyMWWZZGHQGJBYOH-UHFFFAOYSA-N
XLogP0.69
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(1-cyclopentylpiperidin-4-yl)amino]pyridine-2-carboxamide
CID 154797079
4-[(1-methylpyrrolidin-3-yl)amino]pyridine-2-carboxylic acid
CID 61465381
4-[[1-(4-methoxyphenyl)piperidin-4-yl]amino]pyridine-2-carboxamide
CID 133314091
4-[(1,1-dioxothian-3-yl)amino]pyridine-2-carboxamide
CID 63923173
4-[(1-propylpiperidin-4-yl)amino]pyridine-2-carbothioamide
CID 55157619
4-(cyclopropylamino)-N-[4-(4-methylpiperazin-1-yl)phenyl]pyridine-2-carboxamide
CID 109202033
4-[(4-methylcyclohexyl)amino]pyridine-2-carboxylic acid
CID 43143066
N-methyl-4-[(1-propylpiperidin-4-yl)amino]pyridine-2-carboxamide
CID 60703936
4-[[1-(3-chloro-2-pyridinyl)pyrrolidin-3-yl]amino]pyridine-2-carboxamide
CID 154794198
4-hydrazinyl-N-(1-methylpyrrolidin-3-yl)pyridine-2-carboxamide
CID 62248952
ethyl 4-[4-(cyclopropylamino)pyridine-2-carbonyl]piperazine-1-carboxylate
CID 109201937
methyl 4-[[4-(methylamino)cyclohexyl]amino]pyridine-2-carboxylate
CID 79110249

Frequently Asked Questions

What is the IUPAC name of 4-[(1-methylpiperidin-4-yl)amino]pyridine-2-carboxamide?
The IUPAC name of 4-[(1-methylpiperidin-4-yl)amino]pyridine-2-carboxamide (CID 43517657) is 4-[(1-methylpiperidin-4-yl)amino]pyridine-2-carboxamide.
What is the SMILES notation for 4-[(1-methylpiperidin-4-yl)amino]pyridine-2-carboxamide?
The canonical SMILES for 4-[(1-methylpiperidin-4-yl)amino]pyridine-2-carboxamide is CN1CCC(Nc2ccnc(C(N)=O)c2)CC1.
What is the InChIKey of 4-[(1-methylpiperidin-4-yl)amino]pyridine-2-carboxamide?
The InChIKey is MWWZZGHQGJBYOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O/c1-16-6-3-9(4-7-16)15-10-2-5-14-11(8-10)12(13)17/h2,5,8-9H,3-4,6-7H2,1H3,(H2,13,17)(H,14,15).
What are the key properties of 4-[(1-methylpiperidin-4-yl)amino]pyridine-2-carboxamide?
4-[(1-methylpiperidin-4-yl)amino]pyridine-2-carboxamide has a molecular weight of 234.30 g/mol, XLogP of 0.69, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1-methylpiperidin-4-yl)amino]pyridine-2-carboxamide is sourced from PubChem (CID 43517657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).