N-[(4-methylphenyl)methyl]-2-propylcyclopropan-1-amine

C14H21N — CID 103711454

IUPACN-[(4-methylphenyl)methyl]-2-propylcyclopropan-1-amine
SMILESCCCC1CC1NCc1ccc(C)cc1
InChIInChI=1S/C14H21N/c1-3-4-13-9-14(13)15-10-12-7-5-11(2)6-8-12/h5-8,13-15H,3-4,9-10H2,1-2H3
InChIKeyOYBRDTRHBWZWBV-UHFFFAOYSA-N
MW203.33 g/mol
LogP3.27
Rot. Bonds5

About N-[(4-methylphenyl)methyl]-2-propylcyclopropan-1-amine

N-[(4-methylphenyl)methyl]-2-propylcyclopropan-1-amine (PubChem CID 103711454) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is N-[(4-methylphenyl)methyl]-2-propylcyclopropan-1-amine.

Molecular Properties

Compound NameN-[(4-methylphenyl)methyl]-2-propylcyclopropan-1-amine
PubChem CID103711454
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC NameN-[(4-methylphenyl)methyl]-2-propylcyclopropan-1-amine
SMILESCCCC1CC1NCc1ccc(C)cc1
InChIInChI=1S/C14H21N/c1-3-4-13-9-14(13)15-10-12-7-5-11(2)6-8-12/h5-8,13-15H,3-4,9-10H2,1-2H3
InChIKeyOYBRDTRHBWZWBV-UHFFFAOYSA-N
XLogP3.27
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(3,4-dimethylphenyl)methyl]-2-propylcyclopropan-1-amine
CID 103711594
4-[[(2-propylcyclopropyl)amino]methyl]benzonitrile
CID 103711563
N-[(4-methoxyphenyl)methyl]-2-propylcyclopropan-1-amine;hydrochloride
CID 115664685
N-[(1-ethylpyrrol-3-yl)methyl]-2-propylcyclopropan-1-amine
CID 103270528
N-[(2-fluoro-5-methylphenyl)methyl]-2-propylcyclopropan-1-amine;hydrochloride
CID 115664737
2-propyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)cyclopropan-1-amine
CID 114111276
1-N-[(4-methylphenyl)methyl]-2-N-[(4-propylphenyl)methyl]cyclohexane-1,2-diamine;dihydrochloride
CID 71502123
3-[[(2-propylcyclopropyl)amino]methyl]benzonitrile;hydrochloride
CID 115664716
N-[(5-fluoro-2-methylphenyl)methyl]-2-propylcyclopropan-1-amine
CID 115968233
N-[(2-methoxyphenyl)methyl]-2-propylcyclopropan-1-amine
CID 103711434
2-[(4-methylphenyl)methylamino]cyclohexan-1-ol
CID 60714627
1-N-benzyl-2-N-[(4-methylphenyl)methyl]cyclohexane-1,2-diamine
CID 71501767

Frequently Asked Questions

What is the IUPAC name of N-[(4-methylphenyl)methyl]-2-propylcyclopropan-1-amine?
The IUPAC name of N-[(4-methylphenyl)methyl]-2-propylcyclopropan-1-amine (CID 103711454) is N-[(4-methylphenyl)methyl]-2-propylcyclopropan-1-amine.
What is the SMILES notation for N-[(4-methylphenyl)methyl]-2-propylcyclopropan-1-amine?
The canonical SMILES for N-[(4-methylphenyl)methyl]-2-propylcyclopropan-1-amine is CCCC1CC1NCc1ccc(C)cc1.
What is the InChIKey of N-[(4-methylphenyl)methyl]-2-propylcyclopropan-1-amine?
The InChIKey is OYBRDTRHBWZWBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-3-4-13-9-14(13)15-10-12-7-5-11(2)6-8-12/h5-8,13-15H,3-4,9-10H2,1-2H3.
What are the key properties of N-[(4-methylphenyl)methyl]-2-propylcyclopropan-1-amine?
N-[(4-methylphenyl)methyl]-2-propylcyclopropan-1-amine has a molecular weight of 203.33 g/mol, XLogP of 3.27, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methylphenyl)methyl]-2-propylcyclopropan-1-amine is sourced from PubChem (CID 103711454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).