1-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(1-phenylcyclopropyl)methanamine

C20H23N — CID 62881063

IUPAC1-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(1-phenylcyclopropyl)methanamine
SMILESCNC(c1ccc2c(c1)CCC2)C1(c2ccccc2)CC1
InChIInChI=1S/C20H23N/c1-21-19(17-11-10-15-6-5-7-16(15)14-17)20(12-13-20)18-8-3-2-4-9-18/h2-4,8-11,14,19,21H,5-7,12-13H2,1H3
InChIKeyLLLZFDIECFYLRU-UHFFFAOYSA-N
MW277.41 g/mol
LogP4.17
Rot. Bonds4

About 1-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(1-phenylcyclopropyl)methanamine

1-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(1-phenylcyclopropyl)methanamine (PubChem CID 62881063) has the molecular formula C20H23N and a molecular weight of 277.41 g/mol. Its IUPAC name is 1-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(1-phenylcyclopropyl)methanamine.

Molecular Properties

Compound Name1-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(1-phenylcyclopropyl)methanamine
PubChem CID62881063
Molecular FormulaC20H23N
Molecular Weight277.41 g/mol
Exact Mass277.18
IUPAC Name1-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(1-phenylcyclopropyl)methanamine
SMILESCNC(c1ccc2c(c1)CCC2)C1(c2ccccc2)CC1
InChIInChI=1S/C20H23N/c1-21-19(17-11-10-15-6-5-7-16(15)14-17)20(12-13-20)18-8-3-2-4-9-18/h2-4,8-11,14,19,21H,5-7,12-13H2,1H3
InChIKeyLLLZFDIECFYLRU-UHFFFAOYSA-N
XLogP4.17
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-methyl-1-(3-methylphenyl)-1-(1-phenylcyclopropyl)methanamine
CID 63080920
N-methyl-1-(3-methylphenyl)-1-(1-phenylcyclopentyl)methanamine
CID 63417580
1-(3-bromo-4-fluorophenyl)-N-methyl-1-(1-phenylcyclopropyl)methanamine
CID 79747261
N-methyl-1-(1-phenylcyclopropyl)-1-thiophen-3-ylmethanamine
CID 65104923
1-bromo-1-(2,3-dihydro-1H-inden-5-yl)-N-methylmethanamine
CID 116961881
N-methyl-1-(1-phenylcyclobutyl)-1-thiophen-3-ylmethanamine
CID 65105093
N-methyl-1-(5-methylthiophen-3-yl)-1-(1-phenylcyclohexyl)methanamine
CID 65104467
N,N'-dimethyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanediamine
CID 116954289
1-(2,3-dihydro-1H-inden-2-yl)-1-(2,3-dihydro-1H-inden-5-yl)-N-methylmethanamine
CID 106892701
1-(2-methoxyphenyl)-N-methyl-1-(1-phenylcyclopropyl)methanamine
CID 63078449
[(3,4-dimethylphenyl)-(1-phenylcyclobutyl)methyl]hydrazine
CID 105217373
1-(2,6-difluoro-3-methylphenyl)-N-methyl-1-(1-phenylcyclopropyl)methanamine
CID 82803625

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(1-phenylcyclopropyl)methanamine?
The IUPAC name of 1-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(1-phenylcyclopropyl)methanamine (CID 62881063) is 1-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(1-phenylcyclopropyl)methanamine.
What is the SMILES notation for 1-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(1-phenylcyclopropyl)methanamine?
The canonical SMILES for 1-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(1-phenylcyclopropyl)methanamine is CNC(c1ccc2c(c1)CCC2)C1(c2ccccc2)CC1.
What is the InChIKey of 1-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(1-phenylcyclopropyl)methanamine?
The InChIKey is LLLZFDIECFYLRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N/c1-21-19(17-11-10-15-6-5-7-16(15)14-17)20(12-13-20)18-8-3-2-4-9-18/h2-4,8-11,14,19,21H,5-7,12-13H2,1H3.
What are the key properties of 1-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(1-phenylcyclopropyl)methanamine?
1-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(1-phenylcyclopropyl)methanamine has a molecular weight of 277.41 g/mol, XLogP of 4.17, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(1-phenylcyclopropyl)methanamine is sourced from PubChem (CID 62881063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).