N-[(1-methylindazol-3-yl)methyl]-1-pyrrolidin-1-ylpropan-2-amine

C16H24N4 — CID 63001915

IUPACN-[(1-methylindazol-3-yl)methyl]-1-pyrrolidin-1-ylpropan-2-amine
SMILESCC(CN1CCCC1)NCc1nn(C)c2ccccc12
InChIInChI=1S/C16H24N4/c1-13(12-20-9-5-6-10-20)17-11-15-14-7-3-4-8-16(14)19(2)18-15/h3-4,7-8,13,17H,5-6,9-12H2,1-2H3
InChIKeyDUDUZTQGWJJIFO-UHFFFAOYSA-N
MW272.40 g/mol
LogP2.15
Rot. Bonds5

About N-[(1-methylindazol-3-yl)methyl]-1-pyrrolidin-1-ylpropan-2-amine

N-[(1-methylindazol-3-yl)methyl]-1-pyrrolidin-1-ylpropan-2-amine (PubChem CID 63001915) has the molecular formula C16H24N4 and a molecular weight of 272.40 g/mol. Its IUPAC name is N-[(1-methylindazol-3-yl)methyl]-1-pyrrolidin-1-ylpropan-2-amine.

Molecular Properties

Compound NameN-[(1-methylindazol-3-yl)methyl]-1-pyrrolidin-1-ylpropan-2-amine
PubChem CID63001915
Molecular FormulaC16H24N4
Molecular Weight272.40 g/mol
Exact Mass272.20
IUPAC NameN-[(1-methylindazol-3-yl)methyl]-1-pyrrolidin-1-ylpropan-2-amine
SMILESCC(CN1CCCC1)NCc1nn(C)c2ccccc12
InChIInChI=1S/C16H24N4/c1-13(12-20-9-5-6-10-20)17-11-15-14-7-3-4-8-16(14)19(2)18-15/h3-4,7-8,13,17H,5-6,9-12H2,1-2H3
InChIKeyDUDUZTQGWJJIFO-UHFFFAOYSA-N
XLogP2.15
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.40
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[(1-methylindazol-3-yl)methyl]-1-pyrrolidin-1-ylpropan-2-amine 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-[(1-methylindazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine
CID 63000817
N-[(1-methylindazol-3-yl)methyl]-1-methylsulfanylpropan-2-amine
CID 115639747
1-imidazol-1-yl-N-[(1-methylindazol-3-yl)methyl]propan-2-amine
CID 63000923
1,1-dicyclopropyl-N-[(1-methylindazol-3-yl)methyl]methanamine
CID 63001612
N-(1-benzofuran-3-ylmethyl)-1-pyrrolidin-1-ylpropan-2-amine
CID 80701226
(2R)-2-[(1-methylindazol-3-yl)methylamino]propanoic acid
CID 83195291
4-methyl-3-[(1-methylindazol-3-yl)methylamino]pentan-1-ol
CID 103701006
(1S)-N-[(1-methylindazol-3-yl)methyl]-1-(4-methylphenyl)ethanamine
CID 81349025
(1R)-1-(4-fluorophenyl)-N-[(1-methylindazol-3-yl)methyl]ethanamine
CID 81348302
(1R)-1-(2-bromophenyl)-N-[(1-methylindazol-3-yl)methyl]ethanamine
CID 81378061
N-methyl-1-(1-methylindazol-3-yl)methanamine;hydrochloride
CID 131083250
2-[(1-pyrrolidin-1-ylpropan-2-ylamino)methyl]phenol
CID 54953010

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylindazol-3-yl)methyl]-1-pyrrolidin-1-ylpropan-2-amine?
The IUPAC name of N-[(1-methylindazol-3-yl)methyl]-1-pyrrolidin-1-ylpropan-2-amine (CID 63001915) is N-[(1-methylindazol-3-yl)methyl]-1-pyrrolidin-1-ylpropan-2-amine.
What is the SMILES notation for N-[(1-methylindazol-3-yl)methyl]-1-pyrrolidin-1-ylpropan-2-amine?
The canonical SMILES for N-[(1-methylindazol-3-yl)methyl]-1-pyrrolidin-1-ylpropan-2-amine is CC(CN1CCCC1)NCc1nn(C)c2ccccc12.
What is the InChIKey of N-[(1-methylindazol-3-yl)methyl]-1-pyrrolidin-1-ylpropan-2-amine?
The InChIKey is DUDUZTQGWJJIFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4/c1-13(12-20-9-5-6-10-20)17-11-15-14-7-3-4-8-16(14)19(2)18-15/h3-4,7-8,13,17H,5-6,9-12H2,1-2H3.
What are the key properties of N-[(1-methylindazol-3-yl)methyl]-1-pyrrolidin-1-ylpropan-2-amine?
N-[(1-methylindazol-3-yl)methyl]-1-pyrrolidin-1-ylpropan-2-amine has a molecular weight of 272.40 g/mol, XLogP of 2.15, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylindazol-3-yl)methyl]-1-pyrrolidin-1-ylpropan-2-amine is sourced from PubChem (CID 63001915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).