N-methyl-2-(2-propylphenyl)propan-1-amine

C13H21N — CID 105425339

IUPACN-methyl-2-(2-propylphenyl)propan-1-amine
SMILESCCCc1ccccc1C(C)CNC
InChIInChI=1S/C13H21N/c1-4-7-12-8-5-6-9-13(12)11(2)10-14-3/h5-6,8-9,11,14H,4,7,10H2,1-3H3
InChIKeyPQWCPMLPBYCYEA-UHFFFAOYSA-N
MW191.32 g/mol
LogP2.96
Rot. Bonds5

About N-methyl-2-(2-propylphenyl)propan-1-amine

N-methyl-2-(2-propylphenyl)propan-1-amine (PubChem CID 105425339) has the molecular formula C13H21N and a molecular weight of 191.32 g/mol. Its IUPAC name is N-methyl-2-(2-propylphenyl)propan-1-amine.

Molecular Properties

Compound NameN-methyl-2-(2-propylphenyl)propan-1-amine
PubChem CID105425339
Molecular FormulaC13H21N
Molecular Weight191.32 g/mol
Exact Mass191.17
IUPAC NameN-methyl-2-(2-propylphenyl)propan-1-amine
SMILESCCCc1ccccc1C(C)CNC
InChIInChI=1S/C13H21N/c1-4-7-12-8-5-6-9-13(12)11(2)10-14-3/h5-6,8-9,11,14H,4,7,10H2,1-3H3
InChIKeyPQWCPMLPBYCYEA-UHFFFAOYSA-N
XLogP2.96
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.32
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-ethylphenyl)-N-methylpropan-1-amine
CID 105425338
1-(1-phenylpropan-2-yl)-2-propylbenzene
CID 18968363
1-[(E)-hex-4-en-2-yl]-2-propylbenzene
CID 145391504
1-butan-2-yl-2-butylbenzene;ethane;propane
CID 144927563
1-(4-cyclohexylbutan-2-yl)-2-propylbenzene
CID 142148571
(2S)-2-(cyclodecapentaenyl)-N-methylpropan-1-amine
CID 166722722
1-butyl-2-[1-(2-butylphenyl)ethyl]benzene
CID 19828902
1-ethyl-2-[(2S)-pentan-2-yl]benzene
CID 144927407
1-(1-isocyanatoethyl)-2-propylbenzene
CID 105443728
N-methylpropan-2-amine;1-propyl-2-tetradecylbenzene
CID 158412093
1-butan-2-yl-2-(2-phenylethyl)benzene
CID 22235126
2-amino-2-methyl-1-(2-propylphenyl)propane-1-thiol
CID 155137314

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(2-propylphenyl)propan-1-amine?
The IUPAC name of N-methyl-2-(2-propylphenyl)propan-1-amine (CID 105425339) is N-methyl-2-(2-propylphenyl)propan-1-amine.
What is the SMILES notation for N-methyl-2-(2-propylphenyl)propan-1-amine?
The canonical SMILES for N-methyl-2-(2-propylphenyl)propan-1-amine is CCCc1ccccc1C(C)CNC.
What is the InChIKey of N-methyl-2-(2-propylphenyl)propan-1-amine?
The InChIKey is PQWCPMLPBYCYEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N/c1-4-7-12-8-5-6-9-13(12)11(2)10-14-3/h5-6,8-9,11,14H,4,7,10H2,1-3H3.
What are the key properties of N-methyl-2-(2-propylphenyl)propan-1-amine?
N-methyl-2-(2-propylphenyl)propan-1-amine has a molecular weight of 191.32 g/mol, XLogP of 2.96, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(2-propylphenyl)propan-1-amine is sourced from PubChem (CID 105425339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).