(2-anilino-1,3-dihydroinden-2-yl)methanol

C16H17NO — CID 61047339

IUPAC(2-anilino-1,3-dihydroinden-2-yl)methanol
SMILESOCC1(Nc2ccccc2)Cc2ccccc2C1
InChIInChI=1S/C16H17NO/c18-12-16(17-15-8-2-1-3-9-15)10-13-6-4-5-7-14(13)11-16/h1-9,17-18H,10-12H2
InChIKeyXWAUZDYHNRQUGK-UHFFFAOYSA-N
MW239.32 g/mol
LogP2.63
Rot. Bonds3

About (2-anilino-1,3-dihydroinden-2-yl)methanol

(2-anilino-1,3-dihydroinden-2-yl)methanol (PubChem CID 61047339) has the molecular formula C16H17NO and a molecular weight of 239.32 g/mol. Its IUPAC name is (2-anilino-1,3-dihydroinden-2-yl)methanol.

Molecular Properties

Compound Name(2-anilino-1,3-dihydroinden-2-yl)methanol
PubChem CID61047339
Molecular FormulaC16H17NO
Molecular Weight239.32 g/mol
Exact Mass239.13
IUPAC Name(2-anilino-1,3-dihydroinden-2-yl)methanol
SMILESOCC1(Nc2ccccc2)Cc2ccccc2C1
InChIInChI=1S/C16H17NO/c18-12-16(17-15-8-2-1-3-9-15)10-13-6-4-5-7-14(13)11-16/h1-9,17-18H,10-12H2
InChIKeyXWAUZDYHNRQUGK-UHFFFAOYSA-N
XLogP2.63
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(1-anilino-4-phenylcyclohexyl)methanol
CID 61046248
[2-(cyclohexylamino)-1,3-dihydroinden-2-yl]methanol
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[6-bromo-2-(3-bromoanilino)-3,4-dihydro-1H-naphthalen-2-yl]methanol
CID 63632410
(5-anilino-6,7,8,9-tetrahydrobenzo[7]annulen-5-yl)methanol
CID 61046616
N-[1-[(1-anilinocyclohexyl)methyl]cyclohexyl]aniline
CID 67403837
[2-(cycloheptylamino)-3,4-dihydro-1H-naphthalen-2-yl]methanol
CID 61055365
(1-anilino-4-propan-2-ylcycloheptyl)methanol
CID 65090420
[1-anilino-4-(2-methylbutan-2-yl)cyclohexyl]methanol
CID 63428039
3-[[[2-(hydroxymethyl)-1,3-dihydroinden-2-yl]amino]methyl]benzamide
CID 166200250
[6-bromo-2-(4-chloroanilino)-3,4-dihydro-1H-naphthalen-2-yl]methanol
CID 63632585
(1-anilino-4-tert-butylcycloheptyl)methanol
CID 65094624
N-(1-prop-2-enylcyclohexyl)aniline
CID 599883

Frequently Asked Questions

What is the IUPAC name of (2-anilino-1,3-dihydroinden-2-yl)methanol?
The IUPAC name of (2-anilino-1,3-dihydroinden-2-yl)methanol (CID 61047339) is (2-anilino-1,3-dihydroinden-2-yl)methanol.
What is the SMILES notation for (2-anilino-1,3-dihydroinden-2-yl)methanol?
The canonical SMILES for (2-anilino-1,3-dihydroinden-2-yl)methanol is OCC1(Nc2ccccc2)Cc2ccccc2C1.
What is the InChIKey of (2-anilino-1,3-dihydroinden-2-yl)methanol?
The InChIKey is XWAUZDYHNRQUGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO/c18-12-16(17-15-8-2-1-3-9-15)10-13-6-4-5-7-14(13)11-16/h1-9,17-18H,10-12H2.
What are the key properties of (2-anilino-1,3-dihydroinden-2-yl)methanol?
(2-anilino-1,3-dihydroinden-2-yl)methanol has a molecular weight of 239.32 g/mol, XLogP of 2.63, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-anilino-1,3-dihydroinden-2-yl)methanol is sourced from PubChem (CID 61047339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).