4-[[1-(hydroxymethyl)cyclopropyl]methylamino]cyclohexan-1-ol

C11H21NO2 — CID 106594924

IUPAC4-[[1-(hydroxymethyl)cyclopropyl]methylamino]cyclohexan-1-ol
SMILESOCC1(CNC2CCC(O)CC2)CC1
InChIInChI=1S/C11H21NO2/c13-8-11(5-6-11)7-12-9-1-3-10(14)4-2-9/h9-10,12-14H,1-8H2
InChIKeyMXDRRUPCYKVQLU-UHFFFAOYSA-N
MW199.29 g/mol
LogP0.65
Rot. Bonds4

About 4-[[1-(hydroxymethyl)cyclopropyl]methylamino]cyclohexan-1-ol

4-[[1-(hydroxymethyl)cyclopropyl]methylamino]cyclohexan-1-ol (PubChem CID 106594924) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 4-[[1-(hydroxymethyl)cyclopropyl]methylamino]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[[1-(hydroxymethyl)cyclopropyl]methylamino]cyclohexan-1-ol
PubChem CID106594924
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name4-[[1-(hydroxymethyl)cyclopropyl]methylamino]cyclohexan-1-ol
SMILESOCC1(CNC2CCC(O)CC2)CC1
InChIInChI=1S/C11H21NO2/c13-8-11(5-6-11)7-12-9-1-3-10(14)4-2-9/h9-10,12-14H,1-8H2
InChIKeyMXDRRUPCYKVQLU-UHFFFAOYSA-N
XLogP0.65
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 50.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

[1-[[(4-propan-2-ylcyclohexyl)amino]methyl]cyclopropyl]methanol
CID 79479823
[1-[[(4-tert-butylcycloheptyl)amino]methyl]cyclopropyl]methanol
CID 115320185
4-[(1-hydroxycyclopentyl)methylamino]cyclohexan-1-ol
CID 103881245
1-[[(4-hydroxycyclohexyl)amino]methyl]cyclohexan-1-ol
CID 103625161
4-[(cyclopropylamino)methyl]-4-methylcyclohexan-1-ol
CID 130531645
[1-[[(1-oxothian-4-yl)amino]methyl]cyclohexyl]methanol
CID 113359582
trans-(1S,2S)-2-[[1-(hydroxymethyl)cyclopentyl]methylamino]cyclopentan-1-ol
CID 102733880
trans-(1S,2S)-2-[[1-(hydroxymethyl)cyclohexyl]methylamino]cyclopentan-1-ol
CID 102733972
1-[4-[[1-(hydroxymethyl)cyclopentyl]methylamino]piperidin-1-yl]ethanone
CID 113293617
N-[(1-benzylcyclopropyl)methyl]cyclopropanamine
CID 66026239
4-[[4-(hydroxymethyl)phenyl]methylamino]cyclohexan-1-ol
CID 107229822
[1-[[(1-propylpiperidin-4-yl)amino]methyl]cyclopentyl]methanol
CID 115358675

Frequently Asked Questions

What is the IUPAC name of 4-[[1-(hydroxymethyl)cyclopropyl]methylamino]cyclohexan-1-ol?
The IUPAC name of 4-[[1-(hydroxymethyl)cyclopropyl]methylamino]cyclohexan-1-ol (CID 106594924) is 4-[[1-(hydroxymethyl)cyclopropyl]methylamino]cyclohexan-1-ol.
What is the SMILES notation for 4-[[1-(hydroxymethyl)cyclopropyl]methylamino]cyclohexan-1-ol?
The canonical SMILES for 4-[[1-(hydroxymethyl)cyclopropyl]methylamino]cyclohexan-1-ol is OCC1(CNC2CCC(O)CC2)CC1.
What is the InChIKey of 4-[[1-(hydroxymethyl)cyclopropyl]methylamino]cyclohexan-1-ol?
The InChIKey is MXDRRUPCYKVQLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c13-8-11(5-6-11)7-12-9-1-3-10(14)4-2-9/h9-10,12-14H,1-8H2.
What are the key properties of 4-[[1-(hydroxymethyl)cyclopropyl]methylamino]cyclohexan-1-ol?
4-[[1-(hydroxymethyl)cyclopropyl]methylamino]cyclohexan-1-ol has a molecular weight of 199.29 g/mol, XLogP of 0.65, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[1-(hydroxymethyl)cyclopropyl]methylamino]cyclohexan-1-ol is sourced from PubChem (CID 106594924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).