N-propan-2-yl-2,3-dihydro-1H-inden-5-amine

C12H17N — CID 10976012

IUPACN-propan-2-yl-2,3-dihydro-1H-inden-5-amine
SMILESCC(C)Nc1ccc2c(c1)CCC2
InChIInChI=1S/C12H17N/c1-9(2)13-12-7-6-10-4-3-5-11(10)8-12/h6-9,13H,3-5H2,1-2H3
InChIKeySKODCHPTCLQVTN-UHFFFAOYSA-N
MW175.27 g/mol
LogP3.00
Rot. Bonds2

About N-propan-2-yl-2,3-dihydro-1H-inden-5-amine

N-propan-2-yl-2,3-dihydro-1H-inden-5-amine (PubChem CID 10976012) has the molecular formula C12H17N and a molecular weight of 175.27 g/mol. Its IUPAC name is N-propan-2-yl-2,3-dihydro-1H-inden-5-amine.

Molecular Properties

Compound NameN-propan-2-yl-2,3-dihydro-1H-inden-5-amine
PubChem CID10976012
Molecular FormulaC12H17N
Molecular Weight175.27 g/mol
Exact Mass175.14
IUPAC NameN-propan-2-yl-2,3-dihydro-1H-inden-5-amine
SMILESCC(C)Nc1ccc2c(c1)CCC2
InChIInChI=1S/C12H17N/c1-9(2)13-12-7-6-10-4-3-5-11(10)8-12/h6-9,13H,3-5H2,1-2H3
InChIKeySKODCHPTCLQVTN-UHFFFAOYSA-N
XLogP3.00
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.27
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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N-Ethyl-p-toluidine
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Benzenamine, N,3-dimethyl-
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Benzenamine, 4,4'-methylenebis[N-(1-methylpropyl)-
CID 110640
N-phenylindan-2-amine
CID 118068
Benzenamine, N,4-dimethyl-
CID 12165
Amiflamine
CID 71221
N,N-dimethyl-4-{[(propan-2-yl)amino]methyl}aniline
CID 2774184
2-Naphthalenamine, N-methyl-
CID 137505
4-Dimethylaminophenethylamine
CID 151268

Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-2,3-dihydro-1H-inden-5-amine?
The IUPAC name of N-propan-2-yl-2,3-dihydro-1H-inden-5-amine (CID 10976012) is N-propan-2-yl-2,3-dihydro-1H-inden-5-amine.
What is the SMILES notation for N-propan-2-yl-2,3-dihydro-1H-inden-5-amine?
The canonical SMILES for N-propan-2-yl-2,3-dihydro-1H-inden-5-amine is CC(C)Nc1ccc2c(c1)CCC2.
What is the InChIKey of N-propan-2-yl-2,3-dihydro-1H-inden-5-amine?
The InChIKey is SKODCHPTCLQVTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N/c1-9(2)13-12-7-6-10-4-3-5-11(10)8-12/h6-9,13H,3-5H2,1-2H3.
What are the key properties of N-propan-2-yl-2,3-dihydro-1H-inden-5-amine?
N-propan-2-yl-2,3-dihydro-1H-inden-5-amine has a molecular weight of 175.27 g/mol, XLogP of 3.00, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-2,3-dihydro-1H-inden-5-amine is sourced from PubChem (CID 10976012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).