1,1-difluoro-3-[(4-methylcyclohexyl)amino]propan-2-ol

C10H19F2NO — CID 103731557

IUPAC1,1-difluoro-3-[(4-methylcyclohexyl)amino]propan-2-ol
SMILESCC1CCC(NCC(O)C(F)F)CC1
InChIInChI=1S/C10H19F2NO/c1-7-2-4-8(5-3-7)13-6-9(14)10(11)12/h7-10,13-14H,2-6H2,1H3
InChIKeyRIYRTUZDIWZRHS-UHFFFAOYSA-N
MW207.26 g/mol
LogP1.78
Rot. Bonds4

About 1,1-difluoro-3-[(4-methylcyclohexyl)amino]propan-2-ol

1,1-difluoro-3-[(4-methylcyclohexyl)amino]propan-2-ol (PubChem CID 103731557) has the molecular formula C10H19F2NO and a molecular weight of 207.26 g/mol. Its IUPAC name is 1,1-difluoro-3-[(4-methylcyclohexyl)amino]propan-2-ol.

Molecular Properties

Compound Name1,1-difluoro-3-[(4-methylcyclohexyl)amino]propan-2-ol
PubChem CID103731557
Molecular FormulaC10H19F2NO
Molecular Weight207.26 g/mol
Exact Mass207.14
IUPAC Name1,1-difluoro-3-[(4-methylcyclohexyl)amino]propan-2-ol
SMILESCC1CCC(NCC(O)C(F)F)CC1
InChIInChI=1S/C10H19F2NO/c1-7-2-4-8(5-3-7)13-6-9(14)10(11)12/h7-10,13-14H,2-6H2,1H3
InChIKeyRIYRTUZDIWZRHS-UHFFFAOYSA-N
XLogP1.78
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.26
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1,1-difluoro-3-[(4-methylcyclohexyl)amino]propan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1,1-difluoro-3-[(4-methylcyclohexyl)methylamino]propan-2-ol
CID 103872936
1,1-difluoro-3-[(1-propan-2-ylpiperidin-4-yl)amino]propan-2-ol
CID 103788055
1,1-difluoro-3-[(3,3,5,5-tetramethylcyclohexyl)amino]propan-2-ol
CID 103991359
1,1-difluoro-3-[(3-methoxycyclobutyl)amino]propan-2-ol
CID 104871868
2-(cyclopropylamino)-N-(3,3-difluoro-2-hydroxypropyl)acetamide
CID 103843951
trans-(1S,3S)-N-(2,2-difluoroethyl)-3-methylcyclopentan-1-amine
CID 162591470
1-[(4-methylcyclohexyl)amino]-3-(4-methylcyclohexyl)oxypropan-2-ol
CID 60633137
1-ethoxy-3-[(4-methylcyclohexyl)amino]propan-2-ol
CID 63931912
3-methyl-3-[[(4-methylcyclohexyl)amino]methyl]pentan-2-ol
CID 115763261
3-[(3-ethoxycyclobutyl)amino]-1,1-difluoropropan-2-ol
CID 103921698
(2S)-1-(cyclopropylamino)propan-2-ol
CID 39234971
3-(1-cyclopropylethylamino)-1,1-difluoropropan-2-ol
CID 103740416

Frequently Asked Questions

What is the IUPAC name of 1,1-difluoro-3-[(4-methylcyclohexyl)amino]propan-2-ol?
The IUPAC name of 1,1-difluoro-3-[(4-methylcyclohexyl)amino]propan-2-ol (CID 103731557) is 1,1-difluoro-3-[(4-methylcyclohexyl)amino]propan-2-ol.
What is the SMILES notation for 1,1-difluoro-3-[(4-methylcyclohexyl)amino]propan-2-ol?
The canonical SMILES for 1,1-difluoro-3-[(4-methylcyclohexyl)amino]propan-2-ol is CC1CCC(NCC(O)C(F)F)CC1.
What is the InChIKey of 1,1-difluoro-3-[(4-methylcyclohexyl)amino]propan-2-ol?
The InChIKey is RIYRTUZDIWZRHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F2NO/c1-7-2-4-8(5-3-7)13-6-9(14)10(11)12/h7-10,13-14H,2-6H2,1H3.
What are the key properties of 1,1-difluoro-3-[(4-methylcyclohexyl)amino]propan-2-ol?
1,1-difluoro-3-[(4-methylcyclohexyl)amino]propan-2-ol has a molecular weight of 207.26 g/mol, XLogP of 1.78, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-difluoro-3-[(4-methylcyclohexyl)amino]propan-2-ol is sourced from PubChem (CID 103731557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).