N-(cyclopropylmethyl)-1-(2-propan-2-yloxyphenyl)ethanamine

C15H23NO — CID 43735006

IUPACN-(cyclopropylmethyl)-1-(2-propan-2-yloxyphenyl)ethanamine
SMILESCC(C)Oc1ccccc1C(C)NCC1CC1
InChIInChI=1S/C15H23NO/c1-11(2)17-15-7-5-4-6-14(15)12(3)16-10-13-8-9-13/h4-7,11-13,16H,8-10H2,1-3H3
InChIKeyOLSHASYKYZCSRP-UHFFFAOYSA-N
MW233.36 g/mol
LogP3.53
Rot. Bonds6

About N-(cyclopropylmethyl)-1-(2-propan-2-yloxyphenyl)ethanamine

N-(cyclopropylmethyl)-1-(2-propan-2-yloxyphenyl)ethanamine (PubChem CID 43735006) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-1-(2-propan-2-yloxyphenyl)ethanamine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-1-(2-propan-2-yloxyphenyl)ethanamine
PubChem CID43735006
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC NameN-(cyclopropylmethyl)-1-(2-propan-2-yloxyphenyl)ethanamine
SMILESCC(C)Oc1ccccc1C(C)NCC1CC1
InChIInChI=1S/C15H23NO/c1-11(2)17-15-7-5-4-6-14(15)12(3)16-10-13-8-9-13/h4-7,11-13,16H,8-10H2,1-3H3
InChIKeyOLSHASYKYZCSRP-UHFFFAOYSA-N
XLogP3.53
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-butan-2-yloxyphenyl)-N-(cyclohexylmethyl)ethanamine
CID 54804387
N-(cyclopropylmethyl)-1-[2-(2-phenoxyethoxy)phenyl]ethanamine
CID 54804997
4-ethyl-N-[1-(2-propan-2-yloxyphenyl)ethyl]cyclohexan-1-amine
CID 43612843
N-[1-(2-propan-2-yloxyphenyl)ethyl]cyclopropanamine
CID 103439093
N-(cyclopropylmethyl)-1-[2-(2-phenylethoxy)phenyl]ethanamine
CID 54804998
(1R)-1-(2-methoxyphenyl)-N-[(1-methylpiperidin-4-yl)methyl]ethanamine
CID 81397127
(1S)-1-(2-methoxyphenyl)-N-[(3-methylcyclohexyl)methyl]ethanamine
CID 81397121
(1R)-1-(2-bromophenyl)-N-[(4-methylcyclohexyl)methyl]ethanamine
CID 81378377
3-methoxy-N-[1-(2-propan-2-yloxyphenyl)ethyl]propan-1-amine
CID 132649493
N-ethyl-1-(2-propan-2-yloxyphenyl)-2-(thian-4-yl)ethanamine
CID 105171035
(1R)-1-(2-chlorophenyl)-N-(cyclobutylmethyl)ethanamine
CID 81377860
N-(cyclohexylmethyl)-1-(2-heptoxyphenyl)ethanamine
CID 54804382

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-1-(2-propan-2-yloxyphenyl)ethanamine?
The IUPAC name of N-(cyclopropylmethyl)-1-(2-propan-2-yloxyphenyl)ethanamine (CID 43735006) is N-(cyclopropylmethyl)-1-(2-propan-2-yloxyphenyl)ethanamine.
What is the SMILES notation for N-(cyclopropylmethyl)-1-(2-propan-2-yloxyphenyl)ethanamine?
The canonical SMILES for N-(cyclopropylmethyl)-1-(2-propan-2-yloxyphenyl)ethanamine is CC(C)Oc1ccccc1C(C)NCC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-1-(2-propan-2-yloxyphenyl)ethanamine?
The InChIKey is OLSHASYKYZCSRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-11(2)17-15-7-5-4-6-14(15)12(3)16-10-13-8-9-13/h4-7,11-13,16H,8-10H2,1-3H3.
What are the key properties of N-(cyclopropylmethyl)-1-(2-propan-2-yloxyphenyl)ethanamine?
N-(cyclopropylmethyl)-1-(2-propan-2-yloxyphenyl)ethanamine has a molecular weight of 233.36 g/mol, XLogP of 3.53, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-1-(2-propan-2-yloxyphenyl)ethanamine is sourced from PubChem (CID 43735006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).