N-(cyclopropylmethyl)-1-(2-methoxyphenyl)propan-1-amine

C14H21NO — CID 43693519

IUPACN-(cyclopropylmethyl)-1-(2-methoxyphenyl)propan-1-amine
SMILESCCC(NCC1CC1)c1ccccc1OC
InChIInChI=1S/C14H21NO/c1-3-13(15-10-11-8-9-11)12-6-4-5-7-14(12)16-2/h4-7,11,13,15H,3,8-10H2,1-2H3
InChIKeyQRTCMXCGYIKZNC-UHFFFAOYSA-N
MW219.33 g/mol
LogP3.15
Rot. Bonds6

About N-(cyclopropylmethyl)-1-(2-methoxyphenyl)propan-1-amine

N-(cyclopropylmethyl)-1-(2-methoxyphenyl)propan-1-amine (PubChem CID 43693519) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-1-(2-methoxyphenyl)propan-1-amine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-1-(2-methoxyphenyl)propan-1-amine
PubChem CID43693519
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC NameN-(cyclopropylmethyl)-1-(2-methoxyphenyl)propan-1-amine
SMILESCCC(NCC1CC1)c1ccccc1OC
InChIInChI=1S/C14H21NO/c1-3-13(15-10-11-8-9-11)12-6-4-5-7-14(12)16-2/h4-7,11,13,15H,3,8-10H2,1-2H3
InChIKeyQRTCMXCGYIKZNC-UHFFFAOYSA-N
XLogP3.15
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-methoxyphenyl)-N-(piperidin-3-ylmethyl)propan-1-amine
CID 80554157
N-[2-(cyclopropylmethoxy)ethyl]-1-(2-methoxyphenyl)propan-1-amine
CID 103782832
1-(2-methoxyphenyl)-N-(pyrrolidin-2-ylmethyl)propan-1-amine
CID 106637287
2-[[1-(2-methoxyphenyl)propylamino]methyl]cyclohexan-1-ol
CID 64929998
2-cyclopropyl-N-ethyl-1-(2-methoxyphenyl)ethanamine
CID 64904236
1-(2-methoxyphenyl)-N-propylpropan-1-amine
CID 43279174
(1S)-1-(2-methoxyphenyl)-N-[(1S)-1-(2-methoxyphenyl)propyl]propan-1-amine
CID 102356404
1-(2-methoxyphenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine
CID 79083025
N-benzyl-1-(2-methoxyphenyl)propan-1-amine
CID 43435153
1-cyclopropyl-N-[1-(2-methoxyphenyl)propyl]propan-1-amine
CID 64918822
1-[1-(2-methoxyphenyl)propylamino]propan-2-ol
CID 43776231
N-(cyclohexylmethyl)-1-(2-fluorophenyl)propan-1-amine
CID 112676916

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-1-(2-methoxyphenyl)propan-1-amine?
The IUPAC name of N-(cyclopropylmethyl)-1-(2-methoxyphenyl)propan-1-amine (CID 43693519) is N-(cyclopropylmethyl)-1-(2-methoxyphenyl)propan-1-amine.
What is the SMILES notation for N-(cyclopropylmethyl)-1-(2-methoxyphenyl)propan-1-amine?
The canonical SMILES for N-(cyclopropylmethyl)-1-(2-methoxyphenyl)propan-1-amine is CCC(NCC1CC1)c1ccccc1OC.
What is the InChIKey of N-(cyclopropylmethyl)-1-(2-methoxyphenyl)propan-1-amine?
The InChIKey is QRTCMXCGYIKZNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-3-13(15-10-11-8-9-11)12-6-4-5-7-14(12)16-2/h4-7,11,13,15H,3,8-10H2,1-2H3.
What are the key properties of N-(cyclopropylmethyl)-1-(2-methoxyphenyl)propan-1-amine?
N-(cyclopropylmethyl)-1-(2-methoxyphenyl)propan-1-amine has a molecular weight of 219.33 g/mol, XLogP of 3.15, 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-methoxyphenyl)propan-1-amine is sourced from PubChem (CID 43693519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).