2-[[1-[4-(cyclopropylmethoxymethyl)cyclohexyl]piperidin-4-yl]amino]cyclopentan-1-ol

C21H38N2O2 — CID 66916826

IUPAC2-[[1-[4-(cyclopropylmethoxymethyl)cyclohexyl]piperidin-4-yl]amino]cyclopentan-1-ol
SMILESOC1CCCC1NC1CCN(C2CCC(COCC3CC3)CC2)CC1
InChIInChI=1S/C21H38N2O2/c24-21-3-1-2-20(21)22-18-10-12-23(13-11-18)19-8-6-17(7-9-19)15-25-14-16-4-5-16/h16-22,24H,1-15H2
InChIKeyMEVMSLSTBKWSLN-UHFFFAOYSA-N
MW350.55 g/mol
LogP2.94
Rot. Bonds7

About 2-[[1-[4-(cyclopropylmethoxymethyl)cyclohexyl]piperidin-4-yl]amino]cyclopentan-1-ol

2-[[1-[4-(cyclopropylmethoxymethyl)cyclohexyl]piperidin-4-yl]amino]cyclopentan-1-ol (PubChem CID 66916826) has the molecular formula C21H38N2O2 and a molecular weight of 350.55 g/mol. Its IUPAC name is 2-[[1-[4-(cyclopropylmethoxymethyl)cyclohexyl]piperidin-4-yl]amino]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[[1-[4-(cyclopropylmethoxymethyl)cyclohexyl]piperidin-4-yl]amino]cyclopentan-1-ol
PubChem CID66916826
Molecular FormulaC21H38N2O2
Molecular Weight350.55 g/mol
Exact Mass350.29
IUPAC Name2-[[1-[4-(cyclopropylmethoxymethyl)cyclohexyl]piperidin-4-yl]amino]cyclopentan-1-ol
SMILESOC1CCCC1NC1CCN(C2CCC(COCC3CC3)CC2)CC1
InChIInChI=1S/C21H38N2O2/c24-21-3-1-2-20(21)22-18-10-12-23(13-11-18)19-8-6-17(7-9-19)15-25-14-16-4-5-16/h16-22,24H,1-15H2
InChIKeyMEVMSLSTBKWSLN-UHFFFAOYSA-N
XLogP2.94
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.55
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[[1-[4-(cyclopropylmethoxymethyl)cyclohexyl]piperidin-4-yl]amino]cyclopentan-1-ol with MolForge

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Related Compounds

trans-(1S,2S)-2-[[1-[4-(ethoxymethyl)cyclohexyl]piperidin-4-yl]amino]cyclohexan-1-ol
CID 140542636
trans-(1R,2R)-2-(cyclopropylamino)cyclopentan-1-ol
CID 92555045
(1S)-2-[[1-[(3S)-pyrrolidin-3-yl]piperidin-4-yl]amino]cyclohexan-1-ol
CID 70252269
cis-(1S,2R)-2-(cyclobutylamino)cyclohexan-1-ol
CID 94414916
(3S)-3-[4-[[(1S,2S)-2-hydroxycyclohexyl]amino]piperidin-1-yl]pyrrolidine-1-carboxylic acid
CID 68631051
2-(cycloheptylamino)cyclopentan-1-ol
CID 60713716
1-cyclopropyl-N-(2,3-dimethylcyclohexyl)piperidin-4-amine
CID 64761871
1-(1-cyclopropylpiperidin-4-yl)-3-(2-hydroxycyclohexyl)urea
CID 110933219
trans-(1R,2R)-2-(cyclopentylamino)cycloheptan-1-ol
CID 93383696
2-[(1-methylpyrrolidin-3-yl)amino]cyclohexan-1-ol
CID 61462250
2-[4-[(2-ethylcyclohexyl)amino]piperidin-1-yl]cyclohexan-1-ol
CID 110017308
1-(1-cyclohexylpiperidin-4-yl)-3-(2-hydroxycyclohexyl)urea
CID 111619277

Frequently Asked Questions

What is the IUPAC name of 2-[[1-[4-(cyclopropylmethoxymethyl)cyclohexyl]piperidin-4-yl]amino]cyclopentan-1-ol?
The IUPAC name of 2-[[1-[4-(cyclopropylmethoxymethyl)cyclohexyl]piperidin-4-yl]amino]cyclopentan-1-ol (CID 66916826) is 2-[[1-[4-(cyclopropylmethoxymethyl)cyclohexyl]piperidin-4-yl]amino]cyclopentan-1-ol.
What is the SMILES notation for 2-[[1-[4-(cyclopropylmethoxymethyl)cyclohexyl]piperidin-4-yl]amino]cyclopentan-1-ol?
The canonical SMILES for 2-[[1-[4-(cyclopropylmethoxymethyl)cyclohexyl]piperidin-4-yl]amino]cyclopentan-1-ol is OC1CCCC1NC1CCN(C2CCC(COCC3CC3)CC2)CC1.
What is the InChIKey of 2-[[1-[4-(cyclopropylmethoxymethyl)cyclohexyl]piperidin-4-yl]amino]cyclopentan-1-ol?
The InChIKey is MEVMSLSTBKWSLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H38N2O2/c24-21-3-1-2-20(21)22-18-10-12-23(13-11-18)19-8-6-17(7-9-19)15-25-14-16-4-5-16/h16-22,24H,1-15H2.
What are the key properties of 2-[[1-[4-(cyclopropylmethoxymethyl)cyclohexyl]piperidin-4-yl]amino]cyclopentan-1-ol?
2-[[1-[4-(cyclopropylmethoxymethyl)cyclohexyl]piperidin-4-yl]amino]cyclopentan-1-ol has a molecular weight of 350.55 g/mol, XLogP of 2.94, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[1-[4-(cyclopropylmethoxymethyl)cyclohexyl]piperidin-4-yl]amino]cyclopentan-1-ol is sourced from PubChem (CID 66916826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).