[1-(propylamino)-3-pyrrolidin-1-ylcyclohexyl]methanol

C14H28N2O — CID 79634717

IUPAC[1-(propylamino)-3-pyrrolidin-1-ylcyclohexyl]methanol
SMILESCCCNC1(CO)CCCC(N2CCCC2)C1
InChIInChI=1S/C14H28N2O/c1-2-8-15-14(12-17)7-5-6-13(11-14)16-9-3-4-10-16/h13,15,17H,2-12H2,1H3
InChIKeyBPWNAXRPIMSGNP-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.76
Rot. Bonds5

About [1-(propylamino)-3-pyrrolidin-1-ylcyclohexyl]methanol

[1-(propylamino)-3-pyrrolidin-1-ylcyclohexyl]methanol (PubChem CID 79634717) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is [1-(propylamino)-3-pyrrolidin-1-ylcyclohexyl]methanol.

Molecular Properties

Compound Name[1-(propylamino)-3-pyrrolidin-1-ylcyclohexyl]methanol
PubChem CID79634717
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name[1-(propylamino)-3-pyrrolidin-1-ylcyclohexyl]methanol
SMILESCCCNC1(CO)CCCC(N2CCCC2)C1
InChIInChI=1S/C14H28N2O/c1-2-8-15-14(12-17)7-5-6-13(11-14)16-9-3-4-10-16/h13,15,17H,2-12H2,1H3
InChIKeyBPWNAXRPIMSGNP-UHFFFAOYSA-N
XLogP1.76
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[3-(4-cyclopropylpiperazin-1-yl)-1-(propylamino)cyclohexyl]methanol
CID 79635833
[1-(propylamino)-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentyl]methanol
CID 79647005
[3-(4-methyl-1,4-diazepan-1-yl)-1-(propylamino)cyclopentyl]methanol
CID 79657020
[3-(2,6-dimethylmorpholin-4-yl)-1-(propylamino)cyclohexyl]methanol
CID 79634551
[3-(4-tert-butylpiperazin-1-yl)-1-(propylamino)cyclopentyl]methanol
CID 79647288
[3-(4-butan-2-ylpiperazin-1-yl)-1-(propylamino)cyclopentyl]methanol
CID 79646989
[3-(3-methoxy-3-methylpiperidin-1-yl)-1-(propylamino)cyclopentyl]methanol
CID 107395960
[3-(azepan-1-yl)-1-(cyclopropylamino)cyclohexyl]methanol
CID 79633952
[1-(ethylamino)-3-(4-methoxypiperidin-1-yl)cyclohexyl]methanol
CID 79640451
[3-(4-chloro-3,5-dimethylpyrazol-1-yl)-1-(propylamino)cyclohexyl]methanol
CID 79641045
[3-(4-bromopyrazol-1-yl)-1-(propylamino)cyclohexyl]methanol
CID 79641286
[3-indazol-1-yl-1-(propylamino)cyclohexyl]methanol
CID 79638462

Frequently Asked Questions

What is the IUPAC name of [1-(propylamino)-3-pyrrolidin-1-ylcyclohexyl]methanol?
The IUPAC name of [1-(propylamino)-3-pyrrolidin-1-ylcyclohexyl]methanol (CID 79634717) is [1-(propylamino)-3-pyrrolidin-1-ylcyclohexyl]methanol.
What is the SMILES notation for [1-(propylamino)-3-pyrrolidin-1-ylcyclohexyl]methanol?
The canonical SMILES for [1-(propylamino)-3-pyrrolidin-1-ylcyclohexyl]methanol is CCCNC1(CO)CCCC(N2CCCC2)C1.
What is the InChIKey of [1-(propylamino)-3-pyrrolidin-1-ylcyclohexyl]methanol?
The InChIKey is BPWNAXRPIMSGNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-2-8-15-14(12-17)7-5-6-13(11-14)16-9-3-4-10-16/h13,15,17H,2-12H2,1H3.
What are the key properties of [1-(propylamino)-3-pyrrolidin-1-ylcyclohexyl]methanol?
[1-(propylamino)-3-pyrrolidin-1-ylcyclohexyl]methanol has a molecular weight of 240.39 g/mol, XLogP of 1.76, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(propylamino)-3-pyrrolidin-1-ylcyclohexyl]methanol is sourced from PubChem (CID 79634717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).