N-tert-butyl-8-cyclopentyl-1,2,3,4-tetrahydronaphthalen-2-amine

C19H29N — CID 57114536

IUPACN-tert-butyl-8-cyclopentyl-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESCC(C)(C)NC1CCc2cccc(C3CCCC3)c2C1
InChIInChI=1S/C19H29N/c1-19(2,3)20-16-12-11-15-9-6-10-17(18(15)13-16)14-7-4-5-8-14/h6,9-10,14,16,20H,4-5,7-8,11-13H2,1-3H3
InChIKeyNTKUHSRHNKUSOP-UHFFFAOYSA-N
MW271.45 g/mol
LogP4.59
Rot. Bonds2

About N-tert-butyl-8-cyclopentyl-1,2,3,4-tetrahydronaphthalen-2-amine

N-tert-butyl-8-cyclopentyl-1,2,3,4-tetrahydronaphthalen-2-amine (PubChem CID 57114536) has the molecular formula C19H29N and a molecular weight of 271.45 g/mol. Its IUPAC name is N-tert-butyl-8-cyclopentyl-1,2,3,4-tetrahydronaphthalen-2-amine.

Molecular Properties

Compound NameN-tert-butyl-8-cyclopentyl-1,2,3,4-tetrahydronaphthalen-2-amine
PubChem CID57114536
Molecular FormulaC19H29N
Molecular Weight271.45 g/mol
Exact Mass271.23
IUPAC NameN-tert-butyl-8-cyclopentyl-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESCC(C)(C)NC1CCc2cccc(C3CCCC3)c2C1
InChIInChI=1S/C19H29N/c1-19(2,3)20-16-12-11-15-9-6-10-17(18(15)13-16)14-7-4-5-8-14/h6,9-10,14,16,20H,4-5,7-8,11-13H2,1-3H3
InChIKeyNTKUHSRHNKUSOP-UHFFFAOYSA-N
XLogP4.59
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.45
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-8-cyclohexyl-N,N-dimethyl-1,2,3,4-tetrahydronaphthalen-2-amine
CID 70144018
1-(tert-butylamino)-2,3-dihydro-1H-indene-4-carboxylic acid
CID 105493193
N-(2-tert-butylcyclohexyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 43223738
1,3-bis(2,6-dicyclohexylphenyl)-2H-imidazole
CID 70215442
N-(cyclopropylmethyl)-8-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride
CID 18331788
tert-butyl N-(4-amino-6,7,8,9-tetrahydro-5H-benzo[7]annulen-7-yl)carbamate
CID 130120349
3-(tert-butylamino)-3,4-dihydro-2H-chromen-5-ol
CID 105477797
8-bromo-N-butan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine
CID 19823465
N-cyclopentyl-2-methyl-2,3-dihydro-1H-inden-1-amine
CID 115889725
CID 66989831
CID 66989831
1-cyclopentyl-2-fluorobenzene
CID 53415938
2,6-di(cycloheptyl)aniline
CID 156891849

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-8-cyclopentyl-1,2,3,4-tetrahydronaphthalen-2-amine?
The IUPAC name of N-tert-butyl-8-cyclopentyl-1,2,3,4-tetrahydronaphthalen-2-amine (CID 57114536) is N-tert-butyl-8-cyclopentyl-1,2,3,4-tetrahydronaphthalen-2-amine.
What is the SMILES notation for N-tert-butyl-8-cyclopentyl-1,2,3,4-tetrahydronaphthalen-2-amine?
The canonical SMILES for N-tert-butyl-8-cyclopentyl-1,2,3,4-tetrahydronaphthalen-2-amine is CC(C)(C)NC1CCc2cccc(C3CCCC3)c2C1.
What is the InChIKey of N-tert-butyl-8-cyclopentyl-1,2,3,4-tetrahydronaphthalen-2-amine?
The InChIKey is NTKUHSRHNKUSOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N/c1-19(2,3)20-16-12-11-15-9-6-10-17(18(15)13-16)14-7-4-5-8-14/h6,9-10,14,16,20H,4-5,7-8,11-13H2,1-3H3.
What are the key properties of N-tert-butyl-8-cyclopentyl-1,2,3,4-tetrahydronaphthalen-2-amine?
N-tert-butyl-8-cyclopentyl-1,2,3,4-tetrahydronaphthalen-2-amine has a molecular weight of 271.45 g/mol, XLogP of 4.59, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-8-cyclopentyl-1,2,3,4-tetrahydronaphthalen-2-amine is sourced from PubChem (CID 57114536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).