N-(2-pyrazol-1-ylethyl)-2,3-dihydro-1H-inden-5-amine

C14H17N3 — CID 54962038

IUPACN-(2-pyrazol-1-ylethyl)-2,3-dihydro-1H-inden-5-amine
SMILESc1cnn(CCNc2ccc3c(c2)CCC3)c1
InChIInChI=1S/C14H17N3/c1-3-12-5-6-14(11-13(12)4-1)15-8-10-17-9-2-7-16-17/h2,5-7,9,11,15H,1,3-4,8,10H2
InChIKeyUSNSOZAZHDULMD-UHFFFAOYSA-N
MW227.31 g/mol
LogP2.48
Rot. Bonds4

About N-(2-pyrazol-1-ylethyl)-2,3-dihydro-1H-inden-5-amine

N-(2-pyrazol-1-ylethyl)-2,3-dihydro-1H-inden-5-amine (PubChem CID 54962038) has the molecular formula C14H17N3 and a molecular weight of 227.31 g/mol. Its IUPAC name is N-(2-pyrazol-1-ylethyl)-2,3-dihydro-1H-inden-5-amine.

Molecular Properties

Compound NameN-(2-pyrazol-1-ylethyl)-2,3-dihydro-1H-inden-5-amine
PubChem CID54962038
Molecular FormulaC14H17N3
Molecular Weight227.31 g/mol
Exact Mass227.14
IUPAC NameN-(2-pyrazol-1-ylethyl)-2,3-dihydro-1H-inden-5-amine
SMILESc1cnn(CCNc2ccc3c(c2)CCC3)c1
InChIInChI=1S/C14H17N3/c1-3-12-5-6-14(11-13(12)4-1)15-8-10-17-9-2-7-16-17/h2,5-7,9,11,15H,1,3-4,8,10H2
InChIKeyUSNSOZAZHDULMD-UHFFFAOYSA-N
XLogP2.48
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2-pyrazol-1-ylethyl)-2,3-dihydro-1H-inden-5-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

3-chloro-4-methyl-N-(2-pyrazol-1-ylethyl)aniline
CID 61491572
N'-(2,3-dihydro-1H-inden-5-yl)-N-ethylethane-1,2-diamine
CID 115205551
N-(3-imidazol-1-ylpropyl)-2,3-dihydro-1H-inden-5-amine
CID 54961387
N-(2-pyrazol-1-ylethyl)pyridin-4-amine
CID 61462969
3-(2-pyrazol-1-ylethylamino)cyclopent-2-en-1-one
CID 104788367
2-chloro-4-(2-pyrazol-1-ylethylamino)benzonitrile
CID 61491902
N'-(2,3-dihydro-1H-inden-5-yl)pentane-1,5-diamine
CID 59229873
2-bromo-4-(2-pyrazol-1-ylethylamino)benzoic acid
CID 107281839
N-(3,3,3-trifluoropropyl)-2,3-dihydro-1H-inden-5-amine
CID 64554180
4-(2-pyrazol-1-ylethylamino)-2-(trifluoromethyl)benzoic acid
CID 62711712
4-butyl-N-(2-pyrazol-1-ylethyl)aniline
CID 54962348
N'-(5,6,7,8-tetrahydronaphthalen-2-yl)ethane-1,2-diamine
CID 82490968

Frequently Asked Questions

What is the IUPAC name of N-(2-pyrazol-1-ylethyl)-2,3-dihydro-1H-inden-5-amine?
The IUPAC name of N-(2-pyrazol-1-ylethyl)-2,3-dihydro-1H-inden-5-amine (CID 54962038) is N-(2-pyrazol-1-ylethyl)-2,3-dihydro-1H-inden-5-amine.
What is the SMILES notation for N-(2-pyrazol-1-ylethyl)-2,3-dihydro-1H-inden-5-amine?
The canonical SMILES for N-(2-pyrazol-1-ylethyl)-2,3-dihydro-1H-inden-5-amine is c1cnn(CCNc2ccc3c(c2)CCC3)c1.
What is the InChIKey of N-(2-pyrazol-1-ylethyl)-2,3-dihydro-1H-inden-5-amine?
The InChIKey is USNSOZAZHDULMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3/c1-3-12-5-6-14(11-13(12)4-1)15-8-10-17-9-2-7-16-17/h2,5-7,9,11,15H,1,3-4,8,10H2.
What are the key properties of N-(2-pyrazol-1-ylethyl)-2,3-dihydro-1H-inden-5-amine?
N-(2-pyrazol-1-ylethyl)-2,3-dihydro-1H-inden-5-amine has a molecular weight of 227.31 g/mol, XLogP of 2.48, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-pyrazol-1-ylethyl)-2,3-dihydro-1H-inden-5-amine is sourced from PubChem (CID 54962038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).