N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2,3-dihydro-1H-inden-2-amine

C15H19N3 — CID 103780736

IUPACN-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2,3-dihydro-1H-inden-2-amine
SMILESCc1n[nH]c(C)c1CNC1Cc2ccccc2C1
InChIInChI=1S/C15H19N3/c1-10-15(11(2)18-17-10)9-16-14-7-12-5-3-4-6-13(12)8-14/h3-6,14,16H,7-9H2,1-2H3,(H,17,18)
InChIKeyJGOFXHOSVSMFDZ-UHFFFAOYSA-N
MW241.34 g/mol
LogP2.28
Rot. Bonds3

About N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2,3-dihydro-1H-inden-2-amine

N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2,3-dihydro-1H-inden-2-amine (PubChem CID 103780736) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2,3-dihydro-1H-inden-2-amine.

Molecular Properties

Compound NameN-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2,3-dihydro-1H-inden-2-amine
PubChem CID103780736
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC NameN-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2,3-dihydro-1H-inden-2-amine
SMILESCc1n[nH]c(C)c1CNC1Cc2ccccc2C1
InChIInChI=1S/C15H19N3/c1-10-15(11(2)18-17-10)9-16-14-7-12-5-3-4-6-13(12)8-14/h3-6,14,16H,7-9H2,1-2H3,(H,17,18)
InChIKeyJGOFXHOSVSMFDZ-UHFFFAOYSA-N
XLogP2.28
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-phenyl-1H,4H,5H,6H,7H-pyrazolo(4,3-c)pyridine dihydrochloride
CID 67337450
3-(2-Methylphenyl)-1,4,5,6,7,8-hexahydropyrazolo[4,5-d]azepine
CID 135367404
(1r,4r)-4-methyl-N-((3-p-tolyl-1,4-dihydroindeno[1,2-c]pyrazol-6-yl)methyl)cyclohexanamine
CID 44428985
1-(4-fluorophenyl)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]cyclopentan-1-amine
CID 72024775
1h-Pyrazolo[4,3-c]pyridine,4,5,6,7-tetrahydro-3-(4-methylphenyl)-,dihydrochloride
CID 76850833
(1r,4r)-4-methyl-N-((3-phenyl-1,4-dihydroindeno[1,2-c]pyrazol-6-yl)methyl)cyclohexanamine
CID 44428980
(1r,4r)-N-((3-(4-(aminomethyl)phenyl)-1,4-dihydroindeno[1,2-c]pyrazol-6-yl)methyl)-4-methylcyclohexanamine
CID 44428999
5-Ethyl-3-phenyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;hydrochloride
CID 45265533
3,5-Dimethyl-4-[4-(2-pyrrolidinyl)phenyl]-1h-pyrazole
CID 137637598
N,N-dimethyl-4-(3-phenyl-1H-pyrazol-5-yl)butan-1-amine
CID 10752767
3-(4-methylphenyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
CID 28750449
N-Methyl-5-phenyl-1H-pyrazole-3-methanamine
CID 22277810

Frequently Asked Questions

What is the IUPAC name of N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2,3-dihydro-1H-inden-2-amine?
The IUPAC name of N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2,3-dihydro-1H-inden-2-amine (CID 103780736) is N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2,3-dihydro-1H-inden-2-amine.
What is the SMILES notation for N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2,3-dihydro-1H-inden-2-amine?
The canonical SMILES for N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2,3-dihydro-1H-inden-2-amine is Cc1n[nH]c(C)c1CNC1Cc2ccccc2C1.
What is the InChIKey of N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2,3-dihydro-1H-inden-2-amine?
The InChIKey is JGOFXHOSVSMFDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-10-15(11(2)18-17-10)9-16-14-7-12-5-3-4-6-13(12)8-14/h3-6,14,16H,7-9H2,1-2H3,(H,17,18).
What are the key properties of N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2,3-dihydro-1H-inden-2-amine?
N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2,3-dihydro-1H-inden-2-amine has a molecular weight of 241.34 g/mol, XLogP of 2.28, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2,3-dihydro-1H-inden-2-amine is sourced from PubChem (CID 103780736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).