N-(1-cyclopropylpropan-2-yl)-1,2,3,4-tetrahydronaphthalen-1-amine

C16H23N — CID 63988882

IUPACN-(1-cyclopropylpropan-2-yl)-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCC(CC1CC1)NC1CCCc2ccccc21
InChIInChI=1S/C16H23N/c1-12(11-13-9-10-13)17-16-8-4-6-14-5-2-3-7-15(14)16/h2-3,5,7,12-13,16-17H,4,6,8-11H2,1H3
InChIKeyIWHZTLBSGRCIQX-UHFFFAOYSA-N
MW229.37 g/mol
LogP3.84
Rot. Bonds4

About N-(1-cyclopropylpropan-2-yl)-1,2,3,4-tetrahydronaphthalen-1-amine

N-(1-cyclopropylpropan-2-yl)-1,2,3,4-tetrahydronaphthalen-1-amine (PubChem CID 63988882) has the molecular formula C16H23N and a molecular weight of 229.37 g/mol. Its IUPAC name is N-(1-cyclopropylpropan-2-yl)-1,2,3,4-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound NameN-(1-cyclopropylpropan-2-yl)-1,2,3,4-tetrahydronaphthalen-1-amine
PubChem CID63988882
Molecular FormulaC16H23N
Molecular Weight229.37 g/mol
Exact Mass229.18
IUPAC NameN-(1-cyclopropylpropan-2-yl)-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCC(CC1CC1)NC1CCCc2ccccc21
InChIInChI=1S/C16H23N/c1-12(11-13-9-10-13)17-16-8-4-6-14-5-2-3-7-15(14)16/h2-3,5,7,12-13,16-17H,4,6,8-11H2,1H3
InChIKeyIWHZTLBSGRCIQX-UHFFFAOYSA-N
XLogP3.84
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.37
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1S)-N-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-amine;(1R)-N-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 158216876
1-N,1-N-dimethyl-2-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propane-1,2-diamine
CID 82946230
N-(1-methoxypropan-2-yl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 43191940
3-(1,2,3,4-tetrahydronaphthalen-1-ylamino)butanoic acid
CID 43652089
N-[(1S)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-1-amine
CID 78956142
N-[(1R)-1-cycloheptylethyl]-1,2,3,4-tetrahydronaphthalen-1-amine
CID 81390131
N-[1-(oxan-4-yl)ethyl]-1,2,3,4-tetrahydronaphthalen-1-amine
CID 103768119
N-(1-methylsulfanylpropan-2-yl)-2,3-dihydro-1H-inden-1-amine
CID 115721717
N-(3-methylbutan-2-yl)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 43131355
(2R)-2-(2,3-dihydro-1H-inden-1-ylamino)propan-1-ol
CID 114986954
(1S)-N-[(2R)-4-(4-methoxyphenyl)butan-2-yl]-1,2,3,4-tetrahydronaphthalen-1-amine
CID 1378447
(2R)-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)butan-1-ol
CID 103922723

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylpropan-2-yl)-1,2,3,4-tetrahydronaphthalen-1-amine?
The IUPAC name of N-(1-cyclopropylpropan-2-yl)-1,2,3,4-tetrahydronaphthalen-1-amine (CID 63988882) is N-(1-cyclopropylpropan-2-yl)-1,2,3,4-tetrahydronaphthalen-1-amine.
What is the SMILES notation for N-(1-cyclopropylpropan-2-yl)-1,2,3,4-tetrahydronaphthalen-1-amine?
The canonical SMILES for N-(1-cyclopropylpropan-2-yl)-1,2,3,4-tetrahydronaphthalen-1-amine is CC(CC1CC1)NC1CCCc2ccccc21.
What is the InChIKey of N-(1-cyclopropylpropan-2-yl)-1,2,3,4-tetrahydronaphthalen-1-amine?
The InChIKey is IWHZTLBSGRCIQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N/c1-12(11-13-9-10-13)17-16-8-4-6-14-5-2-3-7-15(14)16/h2-3,5,7,12-13,16-17H,4,6,8-11H2,1H3.
What are the key properties of N-(1-cyclopropylpropan-2-yl)-1,2,3,4-tetrahydronaphthalen-1-amine?
N-(1-cyclopropylpropan-2-yl)-1,2,3,4-tetrahydronaphthalen-1-amine has a molecular weight of 229.37 g/mol, XLogP of 3.84, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylpropan-2-yl)-1,2,3,4-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 63988882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).