N-[(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)methyl]-2-methylpropan-2-amine

C20H31N — CID 82933323

IUPACN-[(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCC1(C2CCCC2)CCCc2ccccc21
InChIInChI=1S/C20H31N/c1-19(2,3)21-15-20(17-11-5-6-12-17)14-8-10-16-9-4-7-13-18(16)20/h4,7,9,13,17,21H,5-6,8,10-12,14-15H2,1-3H3
InChIKeyBFXOYSDMPVNXLE-UHFFFAOYSA-N
MW285.48 g/mol
LogP4.84
Rot. Bonds3

About N-[(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)methyl]-2-methylpropan-2-amine

N-[(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)methyl]-2-methylpropan-2-amine (PubChem CID 82933323) has the molecular formula C20H31N and a molecular weight of 285.48 g/mol. Its IUPAC name is N-[(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)methyl]-2-methylpropan-2-amine
PubChem CID82933323
Molecular FormulaC20H31N
Molecular Weight285.48 g/mol
Exact Mass285.25
IUPAC NameN-[(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCC1(C2CCCC2)CCCc2ccccc21
InChIInChI=1S/C20H31N/c1-19(2,3)21-15-20(17-11-5-6-12-17)14-8-10-16-9-4-7-13-18(16)20/h4,7,9,13,17,21H,5-6,8,10-12,14-15H2,1-3H3
InChIKeyBFXOYSDMPVNXLE-UHFFFAOYSA-N
XLogP4.84
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.48
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)methanamine
CID 82933231
(1-cyclohexyl-3,4-dihydro-2H-naphthalen-1-yl)methanol
CID 82944714
(1-cyclopropyl-3,4-dihydro-2H-naphthalen-1-yl)methanamine
CID 104819342
2-methyl-N-[[2-methyl-1-(2-methylphenyl)cyclobutyl]methyl]propan-2-amine
CID 66432386
2-methyl-N-[(1-phenylcyclopentyl)methyl]propan-2-amine
CID 55091317
N-[[1-(2-fluorophenyl)-2-methylcyclopropyl]methyl]-2-methylpropan-2-amine
CID 113404814
4-(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)pyridine
CID 158486462
N-methyl-2,3,4,9,10,10a-hexahydro-1H-phenanthren-4a-amine;hydrochloride
CID 19107108
2-(1,2,3,4,9,9a-hexahydrofluoren-4a-yl)ethanamine
CID 57431239
(1S)-1-[(1S)-1-hydroxy-3,4-dihydro-2H-naphthalen-1-yl]-3,4-dihydro-2H-naphthalen-1-ol
CID 10957368
4,4-diethyl-2,3-dihydro-1H-naphthalene
CID 520431
N,N-dimethyl-2,3,4,9,10,10a-hexahydro-1H-phenanthren-4a-amine
CID 15657719

Frequently Asked Questions

What is the IUPAC name of N-[(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)methyl]-2-methylpropan-2-amine (CID 82933323) is N-[(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)methyl]-2-methylpropan-2-amine is CC(C)(C)NCC1(C2CCCC2)CCCc2ccccc21.
What is the InChIKey of N-[(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)methyl]-2-methylpropan-2-amine?
The InChIKey is BFXOYSDMPVNXLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H31N/c1-19(2,3)21-15-20(17-11-5-6-12-17)14-8-10-16-9-4-7-13-18(16)20/h4,7,9,13,17,21H,5-6,8,10-12,14-15H2,1-3H3.
What are the key properties of N-[(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)methyl]-2-methylpropan-2-amine?
N-[(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)methyl]-2-methylpropan-2-amine has a molecular weight of 285.48 g/mol, XLogP of 4.84, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 82933323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).