2-(1-cyclohexylpropylamino)propan-1-ol

C12H25NO — CID 115724810

IUPAC2-(1-cyclohexylpropylamino)propan-1-ol
SMILESCCC(NC(C)CO)C1CCCCC1
InChIInChI=1S/C12H25NO/c1-3-12(13-10(2)9-14)11-7-5-4-6-8-11/h10-14H,3-9H2,1-2H3
InChIKeyRAERNPQTOIGAOI-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.32
Rot. Bonds5

About 2-(1-cyclohexylpropylamino)propan-1-ol

2-(1-cyclohexylpropylamino)propan-1-ol (PubChem CID 115724810) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is 2-(1-cyclohexylpropylamino)propan-1-ol.

Molecular Properties

Compound Name2-(1-cyclohexylpropylamino)propan-1-ol
PubChem CID115724810
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Name2-(1-cyclohexylpropylamino)propan-1-ol
SMILESCCC(NC(C)CO)C1CCCCC1
InChIInChI=1S/C12H25NO/c1-3-12(13-10(2)9-14)11-7-5-4-6-8-11/h10-14H,3-9H2,1-2H3
InChIKeyRAERNPQTOIGAOI-UHFFFAOYSA-N
XLogP2.32
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-(1-cyclopentylethylamino)propan-1-ol
CID 114987079
(3R)-3-(1-cyclopropylpropylamino)butan-1-ol
CID 103871687
2-bromo-N-(1-cyclohexylpropyl)propanamide
CID 107905149
N-[1-(azepan-2-yl)propan-2-yl]-1-cyclohexylpropan-1-amine
CID 79560812
3-(1-cyclohexylpropylamino)propane-1,2-diol
CID 76943229
1-cyclododecyl-N-propylpropan-1-amine
CID 79308094
1-cyclohexylpropylthiourea
CID 62407553
1-cyclohexyl-N-ethylpropan-1-amine
CID 60817829
2-(cyclododecylamino)propan-1-ol
CID 43499740
2-[1-(1-cyclohexylpropylamino)ethyl]benzene-1,3-diol
CID 107710925
2-(1-cyclohexylpropylamino)hexanoic acid
CID 103249990
4-[1-(1-cyclohexylpropylamino)ethyl]phenol
CID 62407507

Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclohexylpropylamino)propan-1-ol?
The IUPAC name of 2-(1-cyclohexylpropylamino)propan-1-ol (CID 115724810) is 2-(1-cyclohexylpropylamino)propan-1-ol.
What is the SMILES notation for 2-(1-cyclohexylpropylamino)propan-1-ol?
The canonical SMILES for 2-(1-cyclohexylpropylamino)propan-1-ol is CCC(NC(C)CO)C1CCCCC1.
What is the InChIKey of 2-(1-cyclohexylpropylamino)propan-1-ol?
The InChIKey is RAERNPQTOIGAOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-3-12(13-10(2)9-14)11-7-5-4-6-8-11/h10-14H,3-9H2,1-2H3.
What are the key properties of 2-(1-cyclohexylpropylamino)propan-1-ol?
2-(1-cyclohexylpropylamino)propan-1-ol has a molecular weight of 199.34 g/mol, XLogP of 2.32, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclohexylpropylamino)propan-1-ol is sourced from PubChem (CID 115724810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).