3-[cyclopropyl(propyl)amino]-4-propan-2-ylcyclohexan-1-ol

C15H29NO — CID 165490869

IUPAC3-[cyclopropyl(propyl)amino]-4-propan-2-ylcyclohexan-1-ol
SMILESCCCN(C1CC1)C1CC(O)CCC1C(C)C
InChIInChI=1S/C15H29NO/c1-4-9-16(12-5-6-12)15-10-13(17)7-8-14(15)11(2)3/h11-15,17H,4-10H2,1-3H3
InChIKeyXZERSFOEWHTAJK-UHFFFAOYSA-N
MW239.40 g/mol
LogP3.05
Rot. Bonds5

About 3-[cyclopropyl(propyl)amino]-4-propan-2-ylcyclohexan-1-ol

3-[cyclopropyl(propyl)amino]-4-propan-2-ylcyclohexan-1-ol (PubChem CID 165490869) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is 3-[cyclopropyl(propyl)amino]-4-propan-2-ylcyclohexan-1-ol.

Molecular Properties

Compound Name3-[cyclopropyl(propyl)amino]-4-propan-2-ylcyclohexan-1-ol
PubChem CID165490869
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC Name3-[cyclopropyl(propyl)amino]-4-propan-2-ylcyclohexan-1-ol
SMILESCCCN(C1CC1)C1CC(O)CCC1C(C)C
InChIInChI=1S/C15H29NO/c1-4-9-16(12-5-6-12)15-10-13(17)7-8-14(15)11(2)3/h11-15,17H,4-10H2,1-3H3
InChIKeyXZERSFOEWHTAJK-UHFFFAOYSA-N
XLogP3.05
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[cyclopropyl(methyl)amino]-4-propan-2-ylcyclohexan-1-ol
CID 165490941
3-[cyclopropyl(propyl)amino]-4-(2-methylbutan-2-yl)cyclohexan-1-ol
CID 165498480
3-[2-ethoxyethyl(methyl)amino]-4-propan-2-ylcyclohexan-1-ol
CID 165496084
3-[3-ethoxypropyl(methyl)amino]-4-propan-2-ylcyclohexan-1-ol
CID 165490881
3-[cyclopropyl(2-methylpropyl)amino]-4-propylcyclohexan-1-ol
CID 165492179
2-[cyclopropyl-(5-methyl-2-propan-2-ylcyclohexyl)amino]acetic acid
CID 65057481
trans-(1R,2R)-2-[cyclopropyl(propyl)amino]cyclopentan-1-ol
CID 102734359
2-[cyclopropyl(propyl)amino]cyclopentan-1-ol
CID 60886759
4-methyl-3-[propan-2-yl(propyl)amino]cyclohexan-1-ol
CID 165491668
(1R,3R,4S)-4-propan-2-ylcyclohexane-1,3-diol
CID 130918219
3-[propan-2-yl(propyl)amino]-4-propylcyclohexan-1-ol
CID 165497914
3-[methyl-(1-methylcyclopentyl)amino]-4-propan-2-ylcyclohexan-1-ol
CID 165496236

Frequently Asked Questions

What is the IUPAC name of 3-[cyclopropyl(propyl)amino]-4-propan-2-ylcyclohexan-1-ol?
The IUPAC name of 3-[cyclopropyl(propyl)amino]-4-propan-2-ylcyclohexan-1-ol (CID 165490869) is 3-[cyclopropyl(propyl)amino]-4-propan-2-ylcyclohexan-1-ol.
What is the SMILES notation for 3-[cyclopropyl(propyl)amino]-4-propan-2-ylcyclohexan-1-ol?
The canonical SMILES for 3-[cyclopropyl(propyl)amino]-4-propan-2-ylcyclohexan-1-ol is CCCN(C1CC1)C1CC(O)CCC1C(C)C.
What is the InChIKey of 3-[cyclopropyl(propyl)amino]-4-propan-2-ylcyclohexan-1-ol?
The InChIKey is XZERSFOEWHTAJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO/c1-4-9-16(12-5-6-12)15-10-13(17)7-8-14(15)11(2)3/h11-15,17H,4-10H2,1-3H3.
What are the key properties of 3-[cyclopropyl(propyl)amino]-4-propan-2-ylcyclohexan-1-ol?
3-[cyclopropyl(propyl)amino]-4-propan-2-ylcyclohexan-1-ol has a molecular weight of 239.40 g/mol, XLogP of 3.05, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[cyclopropyl(propyl)amino]-4-propan-2-ylcyclohexan-1-ol is sourced from PubChem (CID 165490869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).