4-(2-methylpropylamino)cyclohexan-1-ol

C10H21NO — CID 8024862

IUPAC4-(2-methylpropylamino)cyclohexan-1-ol
SMILESCC(C)CNC1CCC(O)CC1
InChIInChI=1S/C10H21NO/c1-8(2)7-11-9-3-5-10(12)6-4-9/h8-12H,3-7H2,1-2H3
InChIKeyINECGCMSFQLSPX-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.54
Rot. Bonds3

About 4-(2-methylpropylamino)cyclohexan-1-ol

4-(2-methylpropylamino)cyclohexan-1-ol (PubChem CID 8024862) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 4-(2-methylpropylamino)cyclohexan-1-ol.

Molecular Properties

Compound Name4-(2-methylpropylamino)cyclohexan-1-ol
PubChem CID8024862
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name4-(2-methylpropylamino)cyclohexan-1-ol
SMILESCC(C)CNC1CCC(O)CC1
InChIInChI=1S/C10H21NO/c1-8(2)7-11-9-3-5-10(12)6-4-9/h8-12H,3-7H2,1-2H3
InChIKeyINECGCMSFQLSPX-UHFFFAOYSA-N
XLogP1.54
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2-cyclopropylpropylamino)cyclohexan-1-ol
CID 106595134
methanol;N-(2-methylpropyl)cyclopentanamine
CID 166557930
(2S)-1-(cyclopropylamino)propan-2-ol
CID 39234971
ethane;N-(2-methylpropyl)cyclopentanamine
CID 156893756
4-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]cyclohexan-1-ol
CID 106594618
N-[4-methyl-2-(2-methylpropyl)pentyl]cyclopropanamine
CID 62530308
cyclohexane-1,4-diol;2-methylbutane
CID 145319923
N-(2,3,5-trimethylhexyl)cyclopropanamine
CID 81016378
N-(4-hydroxycyclohexyl)-3-methylbutane-1-sulfonamide
CID 63856243
N-[3-methyl-2-(2-methylpropoxy)butyl]cyclopropanamine
CID 62445305
N-(2-methylpropyl)oxan-4-amine;molecular hydrogen
CID 156813143
tert-butyl N-[2-[[(4-hydroxycyclohexyl)amino]methyl]-3-methylbutyl]carbamate
CID 107441028

Frequently Asked Questions

What is the IUPAC name of 4-(2-methylpropylamino)cyclohexan-1-ol?
The IUPAC name of 4-(2-methylpropylamino)cyclohexan-1-ol (CID 8024862) is 4-(2-methylpropylamino)cyclohexan-1-ol.
What is the SMILES notation for 4-(2-methylpropylamino)cyclohexan-1-ol?
The canonical SMILES for 4-(2-methylpropylamino)cyclohexan-1-ol is CC(C)CNC1CCC(O)CC1.
What is the InChIKey of 4-(2-methylpropylamino)cyclohexan-1-ol?
The InChIKey is INECGCMSFQLSPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-8(2)7-11-9-3-5-10(12)6-4-9/h8-12H,3-7H2,1-2H3.
What are the key properties of 4-(2-methylpropylamino)cyclohexan-1-ol?
4-(2-methylpropylamino)cyclohexan-1-ol has a molecular weight of 171.28 g/mol, XLogP of 1.54, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylpropylamino)cyclohexan-1-ol is sourced from PubChem (CID 8024862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).