6-amino-N-[3-(4-methylpiperazin-1-yl)propyl]pyridine-3-carboxamide

C14H23N5O — CID 70906155

IUPAC6-amino-N-[3-(4-methylpiperazin-1-yl)propyl]pyridine-3-carboxamide
SMILESCN1CCN(CCCNC(=O)c2ccc(N)nc2)CC1
InChIInChI=1S/C14H23N5O/c1-18-7-9-19(10-8-18)6-2-5-16-14(20)12-3-4-13(15)17-11-12/h3-4,11H,2,5-10H2,1H3,(H2,15,17)(H,16,20)
InChIKeySYCUXCSSWHUSKI-UHFFFAOYSA-N
MW277.37 g/mol
LogP0.03
Rot. Bonds5

About 6-amino-N-[3-(4-methylpiperazin-1-yl)propyl]pyridine-3-carboxamide

6-amino-N-[3-(4-methylpiperazin-1-yl)propyl]pyridine-3-carboxamide (PubChem CID 70906155) has the molecular formula C14H23N5O and a molecular weight of 277.37 g/mol. Its IUPAC name is 6-amino-N-[3-(4-methylpiperazin-1-yl)propyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-amino-N-[3-(4-methylpiperazin-1-yl)propyl]pyridine-3-carboxamide
PubChem CID70906155
Molecular FormulaC14H23N5O
Molecular Weight277.37 g/mol
Exact Mass277.19
IUPAC Name6-amino-N-[3-(4-methylpiperazin-1-yl)propyl]pyridine-3-carboxamide
SMILESCN1CCN(CCCNC(=O)c2ccc(N)nc2)CC1
InChIInChI=1S/C14H23N5O/c1-18-7-9-19(10-8-18)6-2-5-16-14(20)12-3-4-13(15)17-11-12/h3-4,11H,2,5-10H2,1H3,(H2,15,17)(H,16,20)
InChIKeySYCUXCSSWHUSKI-UHFFFAOYSA-N
XLogP0.03
TPSA74.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 50.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 6-amino-N-[3-(4-methylpiperazin-1-yl)propyl]pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-chloro-N-[3-(4-methylpiperazin-1-yl)propyl]pyridine-3-carboxamide
CID 60668368
3,4-diamino-N-[3-(4-methylpiperazin-1-yl)propyl]benzamide
CID 18999787
6-amino-N-(2-piperazin-1-ylethyl)pyridine-3-carboxamide
CID 58772630
6-amino-N-[3-(2-oxopyrrolidin-1-yl)propyl]pyridine-3-carboxamide
CID 143798014
N-[3-(4-methylpiperazin-1-yl)propyl]-4-propan-2-ylbenzamide
CID 59186291
6-amino-N-(5-amino-5-oxopentyl)pyridine-3-carboxamide
CID 114162800
2-amino-N-[3-(4-methylpiperazin-1-yl)propyl]benzamide
CID 61249597
6-amino-N-[(1-methylpyrrolidin-3-yl)methyl]pyridine-3-carboxamide
CID 62160287
2-N,5-N-bis(3-morpholin-4-ylpropyl)pyridine-2,5-dicarboxamide
CID 4595283
6-(4-methylphenyl)-N-(3-pyrrolidin-1-ylpropyl)pyridine-3-carboxamide
CID 53035860
6-amino-N-(3-cyclopentylpropyl)pyridine-3-carboxamide
CID 114137460
6-amino-N-ethylpyridine-3-carboxamide
CID 62073744

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[3-(4-methylpiperazin-1-yl)propyl]pyridine-3-carboxamide?
The IUPAC name of 6-amino-N-[3-(4-methylpiperazin-1-yl)propyl]pyridine-3-carboxamide (CID 70906155) is 6-amino-N-[3-(4-methylpiperazin-1-yl)propyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-amino-N-[3-(4-methylpiperazin-1-yl)propyl]pyridine-3-carboxamide?
The canonical SMILES for 6-amino-N-[3-(4-methylpiperazin-1-yl)propyl]pyridine-3-carboxamide is CN1CCN(CCCNC(=O)c2ccc(N)nc2)CC1.
What is the InChIKey of 6-amino-N-[3-(4-methylpiperazin-1-yl)propyl]pyridine-3-carboxamide?
The InChIKey is SYCUXCSSWHUSKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O/c1-18-7-9-19(10-8-18)6-2-5-16-14(20)12-3-4-13(15)17-11-12/h3-4,11H,2,5-10H2,1H3,(H2,15,17)(H,16,20).
What are the key properties of 6-amino-N-[3-(4-methylpiperazin-1-yl)propyl]pyridine-3-carboxamide?
6-amino-N-[3-(4-methylpiperazin-1-yl)propyl]pyridine-3-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 0.03, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[3-(4-methylpiperazin-1-yl)propyl]pyridine-3-carboxamide is sourced from PubChem (CID 70906155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).