trans-(1R,2R)-2-[(cyclohexylamino)methyl]cyclopentan-1-ol

C12H23NO — CID 15716295

IUPACtrans-(1R,2R)-2-[(cyclohexylamino)methyl]cyclopentan-1-ol
SMILESO[C@@H]1CCC[C@@H]1CNC1CCCCC1
InChIInChI=1S/C12H23NO/c14-12-8-4-5-10(12)9-13-11-6-2-1-3-7-11/h10-14H,1-9H2/t10-,12-/m1/s1
InChIKeyQQVIXGTXUCEIRL-ZYHUDNBSSA-N
MW197.32 g/mol
LogP2.07
Rot. Bonds3

About trans-(1R,2R)-2-[(cyclohexylamino)methyl]cyclopentan-1-ol

trans-(1R,2R)-2-[(cyclohexylamino)methyl]cyclopentan-1-ol (PubChem CID 15716295) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is trans-(1R,2R)-2-[(cyclohexylamino)methyl]cyclopentan-1-ol.

Molecular Properties

Compound Nametrans-(1R,2R)-2-[(cyclohexylamino)methyl]cyclopentan-1-ol
PubChem CID15716295
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Nametrans-(1R,2R)-2-[(cyclohexylamino)methyl]cyclopentan-1-ol
SMILESO[C@@H]1CCC[C@@H]1CNC1CCCCC1
InChIInChI=1S/C12H23NO/c14-12-8-4-5-10(12)9-13-11-6-2-1-3-7-11/h10-14H,1-9H2/t10-,12-/m1/s1
InChIKeyQQVIXGTXUCEIRL-ZYHUDNBSSA-N
XLogP2.07
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(cycloheptylamino)methyl]cyclohexan-1-ol
CID 64928206
2-[(azepan-4-ylamino)methyl]cyclopentan-1-ol
CID 103982373
2-[[(4-aminocyclohexyl)amino]methyl]cyclopentan-1-ol
CID 79741802
2-[[(3-methylcyclohexyl)amino]methyl]cyclohexan-1-ol
CID 64929988
2-[(thietan-3-ylamino)methyl]cyclopentan-1-ol
CID 130951867
2-[[(1-oxothian-4-yl)amino]methyl]cyclohexan-1-ol
CID 64928655
4-[(2-hydroxycyclopentyl)methylamino]cyclohexane-1-carboxylic acid
CID 112753604
cis-(1R,2S)-2-[[[(1S,3R)-3-ethylcyclohexyl]amino]methyl]cyclohexan-1-ol
CID 124834672
2-[[(3-ethylcyclohexyl)amino]methyl]cyclohexan-1-ol
CID 64926892
N-[(2-methylcyclopentyl)methyl]cyclooctanamine
CID 107417462
2-[(cyclopentylamino)methyl]cyclopentan-1-amine
CID 64853218
2-[[(3,3-dimethylcyclopentyl)amino]methyl]cyclohexan-1-ol
CID 80705865

Frequently Asked Questions

What is the IUPAC name of trans-(1R,2R)-2-[(cyclohexylamino)methyl]cyclopentan-1-ol?
The IUPAC name of trans-(1R,2R)-2-[(cyclohexylamino)methyl]cyclopentan-1-ol (CID 15716295) is trans-(1R,2R)-2-[(cyclohexylamino)methyl]cyclopentan-1-ol.
What is the SMILES notation for trans-(1R,2R)-2-[(cyclohexylamino)methyl]cyclopentan-1-ol?
The canonical SMILES for trans-(1R,2R)-2-[(cyclohexylamino)methyl]cyclopentan-1-ol is O[C@@H]1CCC[C@@H]1CNC1CCCCC1.
What is the InChIKey of trans-(1R,2R)-2-[(cyclohexylamino)methyl]cyclopentan-1-ol?
The InChIKey is QQVIXGTXUCEIRL-ZYHUDNBSSA-N. The full InChI is InChI=1S/C12H23NO/c14-12-8-4-5-10(12)9-13-11-6-2-1-3-7-11/h10-14H,1-9H2/t10-,12-/m1/s1.
What are the key properties of trans-(1R,2R)-2-[(cyclohexylamino)methyl]cyclopentan-1-ol?
trans-(1R,2R)-2-[(cyclohexylamino)methyl]cyclopentan-1-ol has a molecular weight of 197.32 g/mol, XLogP of 2.07, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,2R)-2-[(cyclohexylamino)methyl]cyclopentan-1-ol is sourced from PubChem (CID 15716295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).