[2-(cycloheptylamino)-3,4-dihydro-1H-naphthalen-2-yl]methanol

C18H27NO — CID 61055365

IUPAC[2-(cycloheptylamino)-3,4-dihydro-1H-naphthalen-2-yl]methanol
SMILESOCC1(NC2CCCCCC2)CCc2ccccc2C1
InChIInChI=1S/C18H27NO/c20-14-18(19-17-9-3-1-2-4-10-17)12-11-15-7-5-6-8-16(15)13-18/h5-8,17,19-20H,1-4,9-14H2
InChIKeySZCOZSKDGWKMKA-UHFFFAOYSA-N
MW273.42 g/mol
LogP3.22
Rot. Bonds3

About [2-(cycloheptylamino)-3,4-dihydro-1H-naphthalen-2-yl]methanol

[2-(cycloheptylamino)-3,4-dihydro-1H-naphthalen-2-yl]methanol (PubChem CID 61055365) has the molecular formula C18H27NO and a molecular weight of 273.42 g/mol. Its IUPAC name is [2-(cycloheptylamino)-3,4-dihydro-1H-naphthalen-2-yl]methanol.

Molecular Properties

Compound Name[2-(cycloheptylamino)-3,4-dihydro-1H-naphthalen-2-yl]methanol
PubChem CID61055365
Molecular FormulaC18H27NO
Molecular Weight273.42 g/mol
Exact Mass273.21
IUPAC Name[2-(cycloheptylamino)-3,4-dihydro-1H-naphthalen-2-yl]methanol
SMILESOCC1(NC2CCCCCC2)CCc2ccccc2C1
InChIInChI=1S/C18H27NO/c20-14-18(19-17-9-3-1-2-4-10-17)12-11-15-7-5-6-8-16(15)13-18/h5-8,17,19-20H,1-4,9-14H2
InChIKeySZCOZSKDGWKMKA-UHFFFAOYSA-N
XLogP3.22
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.42
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

[2-(cyclohexylamino)-1,3-dihydroinden-2-yl]methanol
CID 61047122
2-(aminomethyl)-N-cyclopropyl-3,4-dihydro-1H-naphthalen-2-amine
CID 62069632
[1-(cycloheptylamino)-2,3-dihydroinden-1-yl]methanol
CID 61054556
2-(cycloheptylamino)-3,4-dihydro-1H-naphthalene-2-carbonitrile
CID 60997796
2-(cyclobutylamino)-3,4-dihydro-1H-naphthalene-2-carboxylic acid
CID 115002582
[1-(cyclopentylamino)cyclododecyl]methanol
CID 63428229
2-[(cyclopentylamino)methyl]-3,4-dihydro-1H-naphthalen-2-ol
CID 115002610
2-(cyclopropylamino)-3,4-dihydro-1H-naphthalene-2-carboxylic acid
CID 60795603
[1-(cyclopropylamino)-3-(1,3-dihydroisoindol-2-yl)cyclohexyl]methanol
CID 79634509
(2-anilino-1,3-dihydroinden-2-yl)methanol
CID 61047339
[1-(cyclohexylamino)-4,4-dimethyl-2,3-dihydronaphthalen-1-yl]methanol
CID 61045098
1-(cyclopentylamino)-2,3-dihydroindene-1-carboxylic acid
CID 61001988

Frequently Asked Questions

What is the IUPAC name of [2-(cycloheptylamino)-3,4-dihydro-1H-naphthalen-2-yl]methanol?
The IUPAC name of [2-(cycloheptylamino)-3,4-dihydro-1H-naphthalen-2-yl]methanol (CID 61055365) is [2-(cycloheptylamino)-3,4-dihydro-1H-naphthalen-2-yl]methanol.
What is the SMILES notation for [2-(cycloheptylamino)-3,4-dihydro-1H-naphthalen-2-yl]methanol?
The canonical SMILES for [2-(cycloheptylamino)-3,4-dihydro-1H-naphthalen-2-yl]methanol is OCC1(NC2CCCCCC2)CCc2ccccc2C1.
What is the InChIKey of [2-(cycloheptylamino)-3,4-dihydro-1H-naphthalen-2-yl]methanol?
The InChIKey is SZCOZSKDGWKMKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27NO/c20-14-18(19-17-9-3-1-2-4-10-17)12-11-15-7-5-6-8-16(15)13-18/h5-8,17,19-20H,1-4,9-14H2.
What are the key properties of [2-(cycloheptylamino)-3,4-dihydro-1H-naphthalen-2-yl]methanol?
[2-(cycloheptylamino)-3,4-dihydro-1H-naphthalen-2-yl]methanol has a molecular weight of 273.42 g/mol, XLogP of 3.22, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(cycloheptylamino)-3,4-dihydro-1H-naphthalen-2-yl]methanol is sourced from PubChem (CID 61055365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).