N,N-dimethyl-6-(3-methylpyrazol-1-yl)-2,3-dihydro-1H-inden-1-amine

C15H19N3 — CID 51348578

IUPACN,N-dimethyl-6-(3-methylpyrazol-1-yl)-2,3-dihydro-1H-inden-1-amine
SMILESCc1ccn(-c2ccc3c(c2)C(N(C)C)CC3)n1
InChIInChI=1S/C15H19N3/c1-11-8-9-18(16-11)13-6-4-12-5-7-15(17(2)3)14(12)10-13/h4,6,8-10,15H,5,7H2,1-3H3
InChIKeyNGHJRYKZHPYCNI-UHFFFAOYSA-N
MW241.34 g/mol
LogP2.73
Rot. Bonds2

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

N,N-dimethyl-6-(3-methylpyrazol-1-yl)-2,3-dihydro-1H-inden-1-amine (PubChem CID 51348578) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is N,N-dimethyl-6-(3-methylpyrazol-1-yl)-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-6-(3-methylpyrazol-1-yl)-2,3-dihydro-1H-inden-1-amine
PubChem CID51348578
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC NameN,N-dimethyl-6-(3-methylpyrazol-1-yl)-2,3-dihydro-1H-inden-1-amine
SMILESCc1ccn(-c2ccc3c(c2)C(N(C)C)CC3)n1
InChIInChI=1S/C15H19N3/c1-11-8-9-18(16-11)13-6-4-12-5-7-15(17(2)3)14(12)10-13/h4,6,8-10,15H,5,7H2,1-3H3
InChIKeyNGHJRYKZHPYCNI-UHFFFAOYSA-N
XLogP2.73
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-6-(3-methylpyrazol-1-yl)-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of N,N-dimethyl-6-(3-methylpyrazol-1-yl)-2,3-dihydro-1H-inden-1-amine (CID 51348578) is N,N-dimethyl-6-(3-methylpyrazol-1-yl)-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for N,N-dimethyl-6-(3-methylpyrazol-1-yl)-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for N,N-dimethyl-6-(3-methylpyrazol-1-yl)-2,3-dihydro-1H-inden-1-amine is Cc1ccn(-c2ccc3c(c2)C(N(C)C)CC3)n1.
What is the InChIKey of N,N-dimethyl-6-(3-methylpyrazol-1-yl)-2,3-dihydro-1H-inden-1-amine?
The InChIKey is NGHJRYKZHPYCNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-11-8-9-18(16-11)13-6-4-12-5-7-15(17(2)3)14(12)10-13/h4,6,8-10,15H,5,7H2,1-3H3.
What are the key properties of N,N-dimethyl-6-(3-methylpyrazol-1-yl)-2,3-dihydro-1H-inden-1-amine?
N,N-dimethyl-6-(3-methylpyrazol-1-yl)-2,3-dihydro-1H-inden-1-amine has a molecular weight of 241.34 g/mol, XLogP of 2.73, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-6-(3-methylpyrazol-1-yl)-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 51348578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).