N-(cyclopropylmethyl)-2-(2,4-dimethylphenyl)cyclopropan-1-amine

C15H21N — CID 135160107

IUPACN-(cyclopropylmethyl)-2-(2,4-dimethylphenyl)cyclopropan-1-amine
SMILESCc1ccc(C2CC2NCC2CC2)c(C)c1
InChIInChI=1S/C15H21N/c1-10-3-6-13(11(2)7-10)14-8-15(14)16-9-12-4-5-12/h3,6-7,12,14-16H,4-5,8-9H2,1-2H3
InChIKeyQDGALTSOELWUPI-UHFFFAOYSA-N
MW215.34 g/mol
LogP3.16
Rot. Bonds4

About N-(cyclopropylmethyl)-2-(2,4-dimethylphenyl)cyclopropan-1-amine

N-(cyclopropylmethyl)-2-(2,4-dimethylphenyl)cyclopropan-1-amine (PubChem CID 135160107) has the molecular formula C15H21N and a molecular weight of 215.34 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-2-(2,4-dimethylphenyl)cyclopropan-1-amine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-2-(2,4-dimethylphenyl)cyclopropan-1-amine
PubChem CID135160107
Molecular FormulaC15H21N
Molecular Weight215.34 g/mol
Exact Mass215.17
IUPAC NameN-(cyclopropylmethyl)-2-(2,4-dimethylphenyl)cyclopropan-1-amine
SMILESCc1ccc(C2CC2NCC2CC2)c(C)c1
InChIInChI=1S/C15H21N/c1-10-3-6-13(11(2)7-10)14-8-15(14)16-9-12-4-5-12/h3,6-7,12,14-16H,4-5,8-9H2,1-2H3
InChIKeyQDGALTSOELWUPI-UHFFFAOYSA-N
XLogP3.16
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,4-dimethyl-1-(2-methylcyclopropyl)benzene
CID 154093761
N-[[2-(2,4-dimethylphenyl)-4-propylcyclohexyl]methyl]ethanamine
CID 81033727
2-(2,4-dimethylphenyl)bicyclo[2.2.1]heptane
CID 15514590
trans-(1R,2S)-2-(2,4-dimethylphenyl)cyclopropan-1-amine
CID 93299529
1-(2-bromocyclopropyl)-2,4-dimethylbenzene
CID 130539902
3-[(1S,2R)-2-(cyclopropylmethylamino)cyclopropyl]-4-methyl-N-(oxan-4-yl)benzamide;hydrochloride
CID 118304183
N-[[2-(2,4-dimethylphenyl)cyclopentyl]methyl]propan-2-amine
CID 81034661
1-(2,4-dimethylcyclohexyl)-2,4-dimethylbenzene
CID 23529825
N-[4-[2-(cyclopropylmethylamino)cyclopropyl]phenyl]-4-methylbenzamide;hydrochloride
CID 90214407
2-(2,4-dimethylphenyl)cyclopropane-1-carbonitrile
CID 116836914
(2R)-2-(2,5-difluorophenyl)-N-(piperidin-4-ylmethyl)cyclopropan-1-amine
CID 138723133
N-[4-[2-(cyclopropylmethylamino)cyclopropyl]-2-methylphenyl]benzamide
CID 90214289

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-2-(2,4-dimethylphenyl)cyclopropan-1-amine?
The IUPAC name of N-(cyclopropylmethyl)-2-(2,4-dimethylphenyl)cyclopropan-1-amine (CID 135160107) is N-(cyclopropylmethyl)-2-(2,4-dimethylphenyl)cyclopropan-1-amine.
What is the SMILES notation for N-(cyclopropylmethyl)-2-(2,4-dimethylphenyl)cyclopropan-1-amine?
The canonical SMILES for N-(cyclopropylmethyl)-2-(2,4-dimethylphenyl)cyclopropan-1-amine is Cc1ccc(C2CC2NCC2CC2)c(C)c1.
What is the InChIKey of N-(cyclopropylmethyl)-2-(2,4-dimethylphenyl)cyclopropan-1-amine?
The InChIKey is QDGALTSOELWUPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N/c1-10-3-6-13(11(2)7-10)14-8-15(14)16-9-12-4-5-12/h3,6-7,12,14-16H,4-5,8-9H2,1-2H3.
What are the key properties of N-(cyclopropylmethyl)-2-(2,4-dimethylphenyl)cyclopropan-1-amine?
N-(cyclopropylmethyl)-2-(2,4-dimethylphenyl)cyclopropan-1-amine has a molecular weight of 215.34 g/mol, XLogP of 3.16, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-2-(2,4-dimethylphenyl)cyclopropan-1-amine is sourced from PubChem (CID 135160107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).