4-[cyclopropylmethyl(propyl)amino]cyclohexan-1-ol

C13H25NO — CID 114762423

IUPAC4-[cyclopropylmethyl(propyl)amino]cyclohexan-1-ol
SMILESCCCN(CC1CC1)C1CCC(O)CC1
InChIInChI=1S/C13H25NO/c1-2-9-14(10-11-3-4-11)12-5-7-13(15)8-6-12/h11-13,15H,2-10H2,1H3
InChIKeyPEQRWJPTWZGRAK-UHFFFAOYSA-N
MW211.35 g/mol
LogP2.41
Rot. Bonds5

About 4-[cyclopropylmethyl(propyl)amino]cyclohexan-1-ol

4-[cyclopropylmethyl(propyl)amino]cyclohexan-1-ol (PubChem CID 114762423) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is 4-[cyclopropylmethyl(propyl)amino]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[cyclopropylmethyl(propyl)amino]cyclohexan-1-ol
PubChem CID114762423
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Name4-[cyclopropylmethyl(propyl)amino]cyclohexan-1-ol
SMILESCCCN(CC1CC1)C1CCC(O)CC1
InChIInChI=1S/C13H25NO/c1-2-9-14(10-11-3-4-11)12-5-7-13(15)8-6-12/h11-13,15H,2-10H2,1H3
InChIKeyPEQRWJPTWZGRAK-UHFFFAOYSA-N
XLogP2.41
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[[cyclopropyl(propyl)amino]methyl]cyclohexan-1-amine
CID 60850888
N-(cyclopropylmethyl)-1-methyl-N-propylpiperidin-4-amine
CID 30983644
N-(cyclopropylmethyl)-N-propylazepan-4-amine
CID 63902557
2-[2-[cyclopropyl(cyclopropylmethyl)amino]ethyl]-1-ethyl-3-(4-hydroxycyclohexyl)guanidine
CID 111190182
5-[[cyclopropyl(propyl)amino]methyl]-2,2-dimethylcyclopentan-1-ol
CID 79855583
N'-cyclopropyl-N-(cyclopropylmethyl)-N'-propylethane-1,2-diamine
CID 60867855
3-methyl-N-(piperidin-4-ylmethyl)-N-propylcyclopentan-1-amine
CID 79715188
2-[[cyclopropyl(propyl)amino]methyl]-4-propylcyclohexan-1-amine
CID 55093550
6-[cyclopropylmethyl(propyl)amino]-2,2-dimethylcyclohexan-1-ol
CID 79836124
2-[(4-aminocyclohexyl)-propylamino]acetamide
CID 79111803
1-[cyclopropyl(cyclopropylmethyl)amino]propan-2-one
CID 64522765
N-(4-hydroxycyclohexyl)-N-propylformamide
CID 143229390

Frequently Asked Questions

What is the IUPAC name of 4-[cyclopropylmethyl(propyl)amino]cyclohexan-1-ol?
The IUPAC name of 4-[cyclopropylmethyl(propyl)amino]cyclohexan-1-ol (CID 114762423) is 4-[cyclopropylmethyl(propyl)amino]cyclohexan-1-ol.
What is the SMILES notation for 4-[cyclopropylmethyl(propyl)amino]cyclohexan-1-ol?
The canonical SMILES for 4-[cyclopropylmethyl(propyl)amino]cyclohexan-1-ol is CCCN(CC1CC1)C1CCC(O)CC1.
What is the InChIKey of 4-[cyclopropylmethyl(propyl)amino]cyclohexan-1-ol?
The InChIKey is PEQRWJPTWZGRAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO/c1-2-9-14(10-11-3-4-11)12-5-7-13(15)8-6-12/h11-13,15H,2-10H2,1H3.
What are the key properties of 4-[cyclopropylmethyl(propyl)amino]cyclohexan-1-ol?
4-[cyclopropylmethyl(propyl)amino]cyclohexan-1-ol has a molecular weight of 211.35 g/mol, XLogP of 2.41, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[cyclopropylmethyl(propyl)amino]cyclohexan-1-ol is sourced from PubChem (CID 114762423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).