N-(3-pyrrolidin-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine

C19H22N2 — CID 60942193

IUPACN-(3-pyrrolidin-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine
SMILESc1cc(NC2Cc3ccccc3C2)cc(N2CCCC2)c1
InChIInChI=1S/C19H22N2/c1-2-7-16-13-18(12-15(16)6-1)20-17-8-5-9-19(14-17)21-10-3-4-11-21/h1-2,5-9,14,18,20H,3-4,10-13H2
InChIKeyVYJGDFXAGDOWBX-UHFFFAOYSA-N
MW278.40 g/mol
LogP3.87
Rot. Bonds3

About N-(3-pyrrolidin-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine

N-(3-pyrrolidin-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine (PubChem CID 60942193) has the molecular formula C19H22N2 and a molecular weight of 278.40 g/mol. Its IUPAC name is N-(3-pyrrolidin-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine.

Molecular Properties

Compound NameN-(3-pyrrolidin-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine
PubChem CID60942193
Molecular FormulaC19H22N2
Molecular Weight278.40 g/mol
Exact Mass278.18
IUPAC NameN-(3-pyrrolidin-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine
SMILESc1cc(NC2Cc3ccccc3C2)cc(N2CCCC2)c1
InChIInChI=1S/C19H22N2/c1-2-7-16-13-18(12-15(16)6-1)20-17-8-5-9-19(14-17)21-10-3-4-11-21/h1-2,5-9,14,18,20H,3-4,10-13H2
InChIKeyVYJGDFXAGDOWBX-UHFFFAOYSA-N
XLogP3.87
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-N-(3-pyrrolidin-1-ylphenyl)cyclobutane-1,3-diamine
CID 80560827
1-methyl-N-(3-pyrrolidin-1-ylphenyl)azepan-4-amine
CID 65070389
N-(3-pyrrolidin-1-ylphenyl)pyrrolidin-3-amine
CID 79730271
N-(3-pyrazol-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine
CID 43740035
N-phosphanyl-3-pyrrolidin-1-ylaniline
CID 59272549
4-ethyl-N-(3-pyrrolidin-1-ylphenyl)cycloheptan-1-amine
CID 65083445
N-(2,3-dihydro-1H-inden-2-yl)-6-pyrrolidin-1-ylpyridin-3-amine
CID 43689613
N-(3-propan-2-ylphenyl)-2,3-dihydro-1H-inden-2-amine
CID 43512915
N-(1-cyclopentylethyl)-3-pyrrolidin-1-ylaniline
CID 62632471
N-[3-(1H-imidazol-2-yl)cyclobutyl]-3-piperidin-1-ylaniline
CID 146102925
N-(3,4-difluorophenyl)-2,3-dihydro-1H-inden-2-amine
CID 43512824
N-pentan-3-yl-3-pyrrolidin-1-ylaniline
CID 54864371

Frequently Asked Questions

What is the IUPAC name of N-(3-pyrrolidin-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine?
The IUPAC name of N-(3-pyrrolidin-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine (CID 60942193) is N-(3-pyrrolidin-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine.
What is the SMILES notation for N-(3-pyrrolidin-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine?
The canonical SMILES for N-(3-pyrrolidin-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine is c1cc(NC2Cc3ccccc3C2)cc(N2CCCC2)c1.
What is the InChIKey of N-(3-pyrrolidin-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine?
The InChIKey is VYJGDFXAGDOWBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2/c1-2-7-16-13-18(12-15(16)6-1)20-17-8-5-9-19(14-17)21-10-3-4-11-21/h1-2,5-9,14,18,20H,3-4,10-13H2.
What are the key properties of N-(3-pyrrolidin-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine?
N-(3-pyrrolidin-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine has a molecular weight of 278.40 g/mol, XLogP of 3.87, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-pyrrolidin-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine is sourced from PubChem (CID 60942193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).