cis-(1R,2S)-2-(cyclopropylmethoxy)cyclohexan-1-amine

C10H19NO — CID 28797806

IUPACcis-(1R,2S)-2-(cyclopropylmethoxy)cyclohexan-1-amine
SMILESN[C@@H]1CCCC[C@@H]1OCC1CC1
InChIInChI=1S/C10H19NO/c11-9-3-1-2-4-10(9)12-7-8-5-6-8/h8-10H,1-7,11H2/t9-,10+/m1/s1
InChIKeyPRFZJEYCAGMHHS-ZJUUUORDSA-N
MW169.27 g/mol
LogP1.68
Rot. Bonds3

About cis-(1R,2S)-2-(cyclopropylmethoxy)cyclohexan-1-amine

cis-(1R,2S)-2-(cyclopropylmethoxy)cyclohexan-1-amine (PubChem CID 28797806) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is cis-(1R,2S)-2-(cyclopropylmethoxy)cyclohexan-1-amine.

Molecular Properties

Compound Namecis-(1R,2S)-2-(cyclopropylmethoxy)cyclohexan-1-amine
PubChem CID28797806
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Namecis-(1R,2S)-2-(cyclopropylmethoxy)cyclohexan-1-amine
SMILESN[C@@H]1CCCC[C@@H]1OCC1CC1
InChIInChI=1S/C10H19NO/c11-9-3-1-2-4-10(9)12-7-8-5-6-8/h8-10H,1-7,11H2/t9-,10+/m1/s1
InChIKeyPRFZJEYCAGMHHS-ZJUUUORDSA-N
XLogP1.68
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(Cyclohexyloxy)cyclopropan-1-amine
CID 21135
(1R,2R)-2-(tert-butoxy)cyclohexan-1-amine hydrochloride
CID 137945227
(1S,2S)-2-(tert-butoxy)cyclohexan-1-amine hydrochloride
CID 137945228
trans-(+-)-2-Cyclohexyloxycyclopropylamine
CID 23618371
rac-(1R,2R)-2-ethoxycyclohexan-1-amine, trans
CID 36689169
trans-2-Ethoxy-cyclohexylamine hydrochloride
CID 66589139
trans-2-Cyclohexyloxycyclopropyl-amine
CID 53990890
(1S,2S)-2-(tert-butoxy)cyclohexan-1-amine
CID 28998143
2-(2-Fluoroethoxy)cyclohexan-1-amine
CID 104285204
2-(3-Fluoropropoxy)cyclohexan-1-amine
CID 104285246
2-Ethoxycyclohexan-1-amine
CID 409909
cis-2-Ethoxycyclohexanamine
CID 10964632

Frequently Asked Questions

What is the IUPAC name of cis-(1R,2S)-2-(cyclopropylmethoxy)cyclohexan-1-amine?
The IUPAC name of cis-(1R,2S)-2-(cyclopropylmethoxy)cyclohexan-1-amine (CID 28797806) is cis-(1R,2S)-2-(cyclopropylmethoxy)cyclohexan-1-amine.
What is the SMILES notation for cis-(1R,2S)-2-(cyclopropylmethoxy)cyclohexan-1-amine?
The canonical SMILES for cis-(1R,2S)-2-(cyclopropylmethoxy)cyclohexan-1-amine is N[C@@H]1CCCC[C@@H]1OCC1CC1.
What is the InChIKey of cis-(1R,2S)-2-(cyclopropylmethoxy)cyclohexan-1-amine?
The InChIKey is PRFZJEYCAGMHHS-ZJUUUORDSA-N. The full InChI is InChI=1S/C10H19NO/c11-9-3-1-2-4-10(9)12-7-8-5-6-8/h8-10H,1-7,11H2/t9-,10+/m1/s1.
What are the key properties of cis-(1R,2S)-2-(cyclopropylmethoxy)cyclohexan-1-amine?
cis-(1R,2S)-2-(cyclopropylmethoxy)cyclohexan-1-amine has a molecular weight of 169.27 g/mol, XLogP of 1.68, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2S)-2-(cyclopropylmethoxy)cyclohexan-1-amine is sourced from PubChem (CID 28797806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).