[2-[bis(2-methylpropyl)amino]phenyl]methanol

C15H25NO — CID 61378074

IUPAC[2-[bis(2-methylpropyl)amino]phenyl]methanol
SMILESCC(C)CN(CC(C)C)c1ccccc1CO
InChIInChI=1S/C15H25NO/c1-12(2)9-16(10-13(3)4)15-8-6-5-7-14(15)11-17/h5-8,12-13,17H,9-11H2,1-4H3
InChIKeyCVDWCTAUZIHEKJ-UHFFFAOYSA-N
MW235.37 g/mol
LogP3.30
Rot. Bonds6

About [2-[bis(2-methylpropyl)amino]phenyl]methanol

[2-[bis(2-methylpropyl)amino]phenyl]methanol (PubChem CID 61378074) has the molecular formula C15H25NO and a molecular weight of 235.37 g/mol. Its IUPAC name is [2-[bis(2-methylpropyl)amino]phenyl]methanol.

Molecular Properties

Compound Name[2-[bis(2-methylpropyl)amino]phenyl]methanol
PubChem CID61378074
Molecular FormulaC15H25NO
Molecular Weight235.37 g/mol
Exact Mass235.19
IUPAC Name[2-[bis(2-methylpropyl)amino]phenyl]methanol
SMILESCC(C)CN(CC(C)C)c1ccccc1CO
InChIInChI=1S/C15H25NO/c1-12(2)9-16(10-13(3)4)15-8-6-5-7-14(15)11-17/h5-8,12-13,17H,9-11H2,1-4H3
InChIKeyCVDWCTAUZIHEKJ-UHFFFAOYSA-N
XLogP3.30
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-[methyl(2-methylpropyl)amino]phenyl]methanol
CID 10130329
N,N-bis(2-methylpropyl)-2-[(2-methylpropylamino)methyl]aniline
CID 63552275
N-ethyl-N-(2-methylpropyl)-2-[(2-methylpropylamino)methyl]aniline
CID 63551148
[2-[bis(2-methylpropyl)amino]-6-chlorophenyl]methanol
CID 63541422
2-[bis(2-methylpropyl)amino]benzenecarbothioamide
CID 61378298
[2-[ethyl(2-methylpropyl)amino]quinolin-4-yl]methanol
CID 61256243
2-[N-(2-amino-2-oxoethyl)-2-(hydroxymethyl)anilino]acetamide
CID 62923312
N,N-bis(2-methylpropyl)aniline
CID 5169898
[2-(hydroxymethyl)phenyl]-methylcarbamic acid
CID 18370050
2-[2-hydroxy-N-(2-methylpropyl)anilino]acetic acid
CID 138423714
2-(methylaminomethyl)-N,N-bis(3-methylbutyl)aniline
CID 107870537
[2-(3-methylbutylsulfanyl)phenyl]methanol
CID 91658036

Frequently Asked Questions

What is the IUPAC name of [2-[bis(2-methylpropyl)amino]phenyl]methanol?
The IUPAC name of [2-[bis(2-methylpropyl)amino]phenyl]methanol (CID 61378074) is [2-[bis(2-methylpropyl)amino]phenyl]methanol.
What is the SMILES notation for [2-[bis(2-methylpropyl)amino]phenyl]methanol?
The canonical SMILES for [2-[bis(2-methylpropyl)amino]phenyl]methanol is CC(C)CN(CC(C)C)c1ccccc1CO.
What is the InChIKey of [2-[bis(2-methylpropyl)amino]phenyl]methanol?
The InChIKey is CVDWCTAUZIHEKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO/c1-12(2)9-16(10-13(3)4)15-8-6-5-7-14(15)11-17/h5-8,12-13,17H,9-11H2,1-4H3.
What are the key properties of [2-[bis(2-methylpropyl)amino]phenyl]methanol?
[2-[bis(2-methylpropyl)amino]phenyl]methanol has a molecular weight of 235.37 g/mol, XLogP of 3.30, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[bis(2-methylpropyl)amino]phenyl]methanol is sourced from PubChem (CID 61378074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).