(R)-cyclopropyl-(2-propan-2-yloxyphenyl)methanamine;hydrochloride

C13H20ClNO — CID 171211944

IUPAC(R)-cyclopropyl-(2-propan-2-yloxyphenyl)methanamine;hydrochloride
SMILESCC(C)Oc1ccccc1[C@H](N)C1CC1.Cl
InChIInChI=1S/C13H19NO.ClH/c1-9(2)15-12-6-4-3-5-11(12)13(14)10-7-8-10;/h3-6,9-10,13H,7-8,14H2,1-2H3;1H/t13-;/m1./s1
InChIKeyJTIQWCUNSCDBEF-BTQNPOSSSA-N
MW241.76 g/mol
LogP3.31
Rot. Bonds4

About (R)-cyclopropyl-(2-propan-2-yloxyphenyl)methanamine;hydrochloride

(R)-cyclopropyl-(2-propan-2-yloxyphenyl)methanamine;hydrochloride (PubChem CID 171211944) has the molecular formula C13H20ClNO and a molecular weight of 241.76 g/mol. Its IUPAC name is (R)-cyclopropyl-(2-propan-2-yloxyphenyl)methanamine;hydrochloride.

Molecular Properties

Compound Name(R)-cyclopropyl-(2-propan-2-yloxyphenyl)methanamine;hydrochloride
PubChem CID171211944
Molecular FormulaC13H20ClNO
Molecular Weight241.76 g/mol
Exact Mass241.12
IUPAC Name(R)-cyclopropyl-(2-propan-2-yloxyphenyl)methanamine;hydrochloride
SMILESCC(C)Oc1ccccc1[C@H](N)C1CC1.Cl
InChIInChI=1S/C13H19NO.ClH/c1-9(2)15-12-6-4-3-5-11(12)13(14)10-7-8-10;/h3-6,9-10,13H,7-8,14H2,1-2H3;1H/t13-;/m1./s1
InChIKeyJTIQWCUNSCDBEF-BTQNPOSSSA-N
XLogP3.31
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.76
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (R)-cyclopropyl-(2-propan-2-yloxyphenyl)methanamine;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(S)-cyclopropyl-[2-(difluoromethoxy)phenyl]methanamine;hydrochloride
CID 171230981
(R)-cyclopropyl-(2-methoxyphenyl)methanamine
CID 45072420
(2-methoxyphenyl)-(4-propan-2-ylcyclohexyl)methanamine
CID 65423601
7-bicyclo[4.1.0]heptanyl-(2-propan-2-yloxyphenyl)methanamine
CID 105018412
(R)-cyclopentyl-(2-methoxyphenyl)methanamine;hydrochloride
CID 171200457
cyclohexyl-[2-(difluoromethoxy)phenyl]methanamine
CID 114981451
(2-phenylcyclopropyl)-(2-propan-2-yloxyphenyl)methanamine
CID 105018334
(4,4-difluorocyclohexyl)-(2-methoxyphenyl)methanamine
CID 105093642
(S)-(2-methoxyphenyl)-(oxan-4-yl)methanamine
CID 131274584
(2-methoxyphenyl)-[4-(trifluoromethyl)cyclohexyl]methanamine
CID 105093730
(2-propan-2-yloxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanamine
CID 105018368
4-[amino-(2-methoxyphenyl)methyl]cyclohexane-1-carboxylic acid
CID 116938818

Frequently Asked Questions

What is the IUPAC name of (R)-cyclopropyl-(2-propan-2-yloxyphenyl)methanamine;hydrochloride?
The IUPAC name of (R)-cyclopropyl-(2-propan-2-yloxyphenyl)methanamine;hydrochloride (CID 171211944) is (R)-cyclopropyl-(2-propan-2-yloxyphenyl)methanamine;hydrochloride.
What is the SMILES notation for (R)-cyclopropyl-(2-propan-2-yloxyphenyl)methanamine;hydrochloride?
The canonical SMILES for (R)-cyclopropyl-(2-propan-2-yloxyphenyl)methanamine;hydrochloride is CC(C)Oc1ccccc1[C@H](N)C1CC1.Cl.
What is the InChIKey of (R)-cyclopropyl-(2-propan-2-yloxyphenyl)methanamine;hydrochloride?
The InChIKey is JTIQWCUNSCDBEF-BTQNPOSSSA-N. The full InChI is InChI=1S/C13H19NO.ClH/c1-9(2)15-12-6-4-3-5-11(12)13(14)10-7-8-10;/h3-6,9-10,13H,7-8,14H2,1-2H3;1H/t13-;/m1./s1.
What are the key properties of (R)-cyclopropyl-(2-propan-2-yloxyphenyl)methanamine;hydrochloride?
(R)-cyclopropyl-(2-propan-2-yloxyphenyl)methanamine;hydrochloride has a molecular weight of 241.76 g/mol, XLogP of 3.31, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-cyclopropyl-(2-propan-2-yloxyphenyl)methanamine;hydrochloride is sourced from PubChem (CID 171211944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).