4-[azetidin-3-yl(propyl)amino]pyridine-2-carboxamide

C12H18N4O — CID 66214733

IUPAC4-[azetidin-3-yl(propyl)amino]pyridine-2-carboxamide
SMILESCCCN(c1ccnc(C(N)=O)c1)C1CNC1
InChIInChI=1S/C12H18N4O/c1-2-5-16(10-7-14-8-10)9-3-4-15-11(6-9)12(13)17/h3-4,6,10,14H,2,5,7-8H2,1H3,(H2,13,17)
InChIKeyNXFKNFIHDLHNGC-UHFFFAOYSA-N
MW234.30 g/mol
LogP0.37
Rot. Bonds5

About 4-[azetidin-3-yl(propyl)amino]pyridine-2-carboxamide

4-[azetidin-3-yl(propyl)amino]pyridine-2-carboxamide (PubChem CID 66214733) has the molecular formula C12H18N4O and a molecular weight of 234.30 g/mol. Its IUPAC name is 4-[azetidin-3-yl(propyl)amino]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-[azetidin-3-yl(propyl)amino]pyridine-2-carboxamide
PubChem CID66214733
Molecular FormulaC12H18N4O
Molecular Weight234.30 g/mol
Exact Mass234.15
IUPAC Name4-[azetidin-3-yl(propyl)amino]pyridine-2-carboxamide
SMILESCCCN(c1ccnc(C(N)=O)c1)C1CNC1
InChIInChI=1S/C12H18N4O/c1-2-5-16(10-7-14-8-10)9-3-4-15-11(6-9)12(13)17/h3-4,6,10,14H,2,5,7-8H2,1H3,(H2,13,17)
InChIKeyNXFKNFIHDLHNGC-UHFFFAOYSA-N
XLogP0.37
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-[azetidin-3-yl(propyl)amino]pyridine-2-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

4-[cyclopropyl(propyl)amino]pyridine-2-carbothioamide
CID 62925199
3-[(2-carbamoyl-4-pyridinyl)-cyclopropylamino]propanoic acid
CID 54925465
4-[(4-aminocyclohexyl)-ethylamino]pyridine-2-carboxamide
CID 79111622
4-[piperidin-3-ylmethyl(propyl)amino]pyridine-2-carboxamide
CID 106644188
4-[3-aminopropyl(cyclohexyl)amino]pyridine-2-carboxamide
CID 43517535
2-[(2-carbamoyl-4-pyridinyl)-propylamino]acetic acid
CID 61007224
2-[azetidin-3-yl(propyl)amino]-4-methylbenzamide
CID 66215739
4-[butyl(methyl)amino]pyridine-2-carboxamide
CID 133313214
4-[(3-aminophenyl)methyl-cyclopropylamino]pyridine-2-carboxamide
CID 60876467
4-[propyl(pyrrolidin-3-yl)amino]pyridine-2-carbonitrile
CID 55205925
2-[azetidin-3-yl(propyl)amino]-6-fluorobenzamide
CID 79523206
4-[3-aminopropyl(cyclopentyl)amino]-N-ethylpyridine-2-carboxamide
CID 43517815

Frequently Asked Questions

What is the IUPAC name of 4-[azetidin-3-yl(propyl)amino]pyridine-2-carboxamide?
The IUPAC name of 4-[azetidin-3-yl(propyl)amino]pyridine-2-carboxamide (CID 66214733) is 4-[azetidin-3-yl(propyl)amino]pyridine-2-carboxamide.
What is the SMILES notation for 4-[azetidin-3-yl(propyl)amino]pyridine-2-carboxamide?
The canonical SMILES for 4-[azetidin-3-yl(propyl)amino]pyridine-2-carboxamide is CCCN(c1ccnc(C(N)=O)c1)C1CNC1.
What is the InChIKey of 4-[azetidin-3-yl(propyl)amino]pyridine-2-carboxamide?
The InChIKey is NXFKNFIHDLHNGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O/c1-2-5-16(10-7-14-8-10)9-3-4-15-11(6-9)12(13)17/h3-4,6,10,14H,2,5,7-8H2,1H3,(H2,13,17).
What are the key properties of 4-[azetidin-3-yl(propyl)amino]pyridine-2-carboxamide?
4-[azetidin-3-yl(propyl)amino]pyridine-2-carboxamide has a molecular weight of 234.30 g/mol, XLogP of 0.37, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[azetidin-3-yl(propyl)amino]pyridine-2-carboxamide is sourced from PubChem (CID 66214733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).