2-(methylamino)-N-[2-(pyridine-3-carbonylamino)ethyl]pyridine-4-carboxamide

C15H17N5O2 — CID 74240609

IUPAC2-(methylamino)-N-[2-(pyridine-3-carbonylamino)ethyl]pyridine-4-carboxamide
SMILESCNc1cc(C(=O)NCCNC(=O)c2cccnc2)ccn1
InChIInChI=1S/C15H17N5O2/c1-16-13-9-11(4-6-18-13)14(21)19-7-8-20-15(22)12-3-2-5-17-10-12/h2-6,9-10H,7-8H2,1H3,(H,16,18)(H,19,21)(H,20,22)
InChIKeyUPAPAZZAWGTPDC-UHFFFAOYSA-N
MW299.33 g/mol
LogP0.68
Rot. Bonds6

About 2-(methylamino)-N-[2-(pyridine-3-carbonylamino)ethyl]pyridine-4-carboxamide

2-(methylamino)-N-[2-(pyridine-3-carbonylamino)ethyl]pyridine-4-carboxamide (PubChem CID 74240609) has the molecular formula C15H17N5O2 and a molecular weight of 299.33 g/mol. Its IUPAC name is 2-(methylamino)-N-[2-(pyridine-3-carbonylamino)ethyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(methylamino)-N-[2-(pyridine-3-carbonylamino)ethyl]pyridine-4-carboxamide
PubChem CID74240609
Molecular FormulaC15H17N5O2
Molecular Weight299.33 g/mol
Exact Mass299.14
IUPAC Name2-(methylamino)-N-[2-(pyridine-3-carbonylamino)ethyl]pyridine-4-carboxamide
SMILESCNc1cc(C(=O)NCCNC(=O)c2cccnc2)ccn1
InChIInChI=1S/C15H17N5O2/c1-16-13-9-11(4-6-18-13)14(21)19-7-8-20-15(22)12-3-2-5-17-10-12/h2-6,9-10H,7-8H2,1H3,(H,16,18)(H,19,21)(H,20,22)
InChIKeyUPAPAZZAWGTPDC-UHFFFAOYSA-N
XLogP0.68
TPSA96.01 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 50.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-(methylamino)-N-[2-(pyridine-3-carbonylamino)ethyl]pyridine-4-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

N-[2-(carbamoylamino)ethyl]-2-(methylamino)pyridine-4-carboxamide
CID 83115078
N-[2-(propan-2-ylamino)ethyl]pyridine-3-carboxamide
CID 4235481
2-(methylamino)-N-[3-(methylamino)-3-oxopropyl]pyridine-4-carboxamide
CID 62175030
N-(2-ethoxyethyl)-2-(methylamino)pyridine-4-carboxamide
CID 62185207
N-[2-[(2-methylbenzoyl)amino]ethyl]pyridine-3-carboxamide
CID 2985921
N-[3-[(3-methylbenzoyl)amino]propyl]pyridine-3-carboxamide
CID 2985562
N-(3-chloropropyl)pyridine-3-carboxamide
CID 17164667
2-(methylamino)-N-[(3-methyl-2-pyridinyl)methyl]pyridine-4-carboxamide
CID 55204056
2-(methylamino)-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide
CID 55042664
N-[2-(4-fluorophenyl)ethyl]-2-(methylamino)pyridine-4-carboxamide
CID 62185958
N-butyl-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide
CID 109165425
N-[2-[(4-ethoxybenzoyl)amino]ethyl]pyridine-3-carboxamide
CID 39580083

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-[2-(pyridine-3-carbonylamino)ethyl]pyridine-4-carboxamide?
The IUPAC name of 2-(methylamino)-N-[2-(pyridine-3-carbonylamino)ethyl]pyridine-4-carboxamide (CID 74240609) is 2-(methylamino)-N-[2-(pyridine-3-carbonylamino)ethyl]pyridine-4-carboxamide.
What is the SMILES notation for 2-(methylamino)-N-[2-(pyridine-3-carbonylamino)ethyl]pyridine-4-carboxamide?
The canonical SMILES for 2-(methylamino)-N-[2-(pyridine-3-carbonylamino)ethyl]pyridine-4-carboxamide is CNc1cc(C(=O)NCCNC(=O)c2cccnc2)ccn1.
What is the InChIKey of 2-(methylamino)-N-[2-(pyridine-3-carbonylamino)ethyl]pyridine-4-carboxamide?
The InChIKey is UPAPAZZAWGTPDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5O2/c1-16-13-9-11(4-6-18-13)14(21)19-7-8-20-15(22)12-3-2-5-17-10-12/h2-6,9-10H,7-8H2,1H3,(H,16,18)(H,19,21)(H,20,22).
What are the key properties of 2-(methylamino)-N-[2-(pyridine-3-carbonylamino)ethyl]pyridine-4-carboxamide?
2-(methylamino)-N-[2-(pyridine-3-carbonylamino)ethyl]pyridine-4-carboxamide has a molecular weight of 299.33 g/mol, XLogP of 0.68, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-[2-(pyridine-3-carbonylamino)ethyl]pyridine-4-carboxamide is sourced from PubChem (CID 74240609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).