6-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2,3-dihydro-1H-inden-1-amine

C15H19N3 — CID 78948041

IUPAC6-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2,3-dihydro-1H-inden-1-amine
SMILESCc1ccc2c(c1)C(NCc1ccn(C)n1)CC2
InChIInChI=1S/C15H19N3/c1-11-3-4-12-5-6-15(14(12)9-11)16-10-13-7-8-18(2)17-13/h3-4,7-9,15-16H,5-6,10H2,1-2H3
InChIKeyKPMVJJQSCVJDTA-UHFFFAOYSA-N
MW241.34 g/mol
LogP2.51
Rot. Bonds3

About 6-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2,3-dihydro-1H-inden-1-amine

6-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2,3-dihydro-1H-inden-1-amine (PubChem CID 78948041) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is 6-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound Name6-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2,3-dihydro-1H-inden-1-amine
PubChem CID78948041
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name6-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2,3-dihydro-1H-inden-1-amine
SMILESCc1ccc2c(c1)C(NCc1ccn(C)n1)CC2
InChIInChI=1S/C15H19N3/c1-11-3-4-12-5-6-15(14(12)9-11)16-10-13-7-8-18(2)17-13/h3-4,7-9,15-16H,5-6,10H2,1-2H3
InChIKeyKPMVJJQSCVJDTA-UHFFFAOYSA-N
XLogP2.51
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1,3-dimethylpyrazol-4-yl)methyl]-6-methyl-2,3-dihydro-1H-inden-1-amine
CID 112705320
6-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2,3-dihydro-1H-inden-1-amine
CID 78948037
6-methyl-N-(2-pyrrolidin-1-ylethyl)-2,3-dihydro-1H-inden-1-amine
CID 81301273
N-[(5-chlorothiophen-2-yl)methyl]-6-methyl-2,3-dihydro-1H-inden-1-amine
CID 78948024
N-[(2-fluorophenyl)methyl]-6-methyl-2,3-dihydro-1H-inden-1-amine
CID 78948023
6-methyl-N-[2-(4-methylpyrazol-1-yl)ethyl]-2,3-dihydro-1H-inden-1-amine
CID 103872004
[3-[[(6-methyl-2,3-dihydro-1H-inden-1-yl)amino]methyl]phenyl]methanol
CID 103781821
(1S)-N-(2-methoxyethyl)-6-methyl-2,3-dihydro-1H-inden-1-amine
CID 97357930
4-[(6-methyl-2,3-dihydro-1H-inden-1-yl)amino]butan-1-ol
CID 106840528
N-[(3-chloro-4-fluorophenyl)methyl]-6-methyl-2,3-dihydro-1H-inden-1-amine
CID 81333353
1-methyl-N-(6-methyl-2,3-dihydro-1H-inden-1-yl)piperidin-4-amine
CID 81300616
3-[(1-methylpyrazol-3-yl)methylamino]oxolan-2-one
CID 131107562

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of 6-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2,3-dihydro-1H-inden-1-amine (CID 78948041) is 6-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for 6-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for 6-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2,3-dihydro-1H-inden-1-amine is Cc1ccc2c(c1)C(NCc1ccn(C)n1)CC2.
What is the InChIKey of 6-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2,3-dihydro-1H-inden-1-amine?
The InChIKey is KPMVJJQSCVJDTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-11-3-4-12-5-6-15(14(12)9-11)16-10-13-7-8-18(2)17-13/h3-4,7-9,15-16H,5-6,10H2,1-2H3.
What are the key properties of 6-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2,3-dihydro-1H-inden-1-amine?
6-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2,3-dihydro-1H-inden-1-amine has a molecular weight of 241.34 g/mol, XLogP of 2.51, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 78948041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).