1-N,3-N-dimethyl-3-N-[(2-methylphenyl)methyl]cyclopentane-1,3-diamine

C15H24N2 — CID 79643894

IUPAC1-N,3-N-dimethyl-3-N-[(2-methylphenyl)methyl]cyclopentane-1,3-diamine
SMILESCNC1CCC(N(C)Cc2ccccc2C)C1
InChIInChI=1S/C15H24N2/c1-12-6-4-5-7-13(12)11-17(3)15-9-8-14(10-15)16-2/h4-7,14-16H,8-11H2,1-3H3
InChIKeyCEZDTPCIAMZDGE-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.57
Rot. Bonds4

About 1-N,3-N-dimethyl-3-N-[(2-methylphenyl)methyl]cyclopentane-1,3-diamine

1-N,3-N-dimethyl-3-N-[(2-methylphenyl)methyl]cyclopentane-1,3-diamine (PubChem CID 79643894) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 1-N,3-N-dimethyl-3-N-[(2-methylphenyl)methyl]cyclopentane-1,3-diamine.

Molecular Properties

Compound Name1-N,3-N-dimethyl-3-N-[(2-methylphenyl)methyl]cyclopentane-1,3-diamine
PubChem CID79643894
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name1-N,3-N-dimethyl-3-N-[(2-methylphenyl)methyl]cyclopentane-1,3-diamine
SMILESCNC1CCC(N(C)Cc2ccccc2C)C1
InChIInChI=1S/C15H24N2/c1-12-6-4-5-7-13(12)11-17(3)15-9-8-14(10-15)16-2/h4-7,14-16H,8-11H2,1-3H3
InChIKeyCEZDTPCIAMZDGE-UHFFFAOYSA-N
XLogP2.57
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-N-[(2,5-dimethylphenyl)methyl]-1-N,4-N-dimethylcyclohexane-1,4-diamine
CID 79122756
1-N,3-N-dimethyl-3-N-[(3-methylphenyl)methyl]cyclopentane-1,3-diamine
CID 79643539
N-methyl-N-[2-(2-methylphenyl)ethyl]cyclopropanamine
CID 67231400
1-(2-aminoethyl)-N-methyl-N-[(2-methylphenyl)methyl]piperidin-4-amine
CID 117041756
N,4-dimethyl-2-[[methyl-[(2-methylphenyl)methyl]amino]methyl]cyclohexan-1-amine
CID 62611056
N-cyclopropyl-2-[methyl-[(2-methylphenyl)methyl]amino]propanamide
CID 71944218
2-[[[4-[(2-hydroxyphenyl)methyl-methylamino]cyclohexyl]-methylamino]methyl]phenol
CID 118815979
4-N-(1H-indol-3-ylmethyl)-1-N,4-N-dimethylcyclohexane-1,4-diamine
CID 79123075
1-N-cyclopropyl-2-N,3-dimethyl-2-N-[(2-methylphenyl)methyl]butane-1,2-diamine
CID 62461524
1-N,4-N-dimethyl-4-N-(quinolin-8-ylmethyl)cyclohexane-1,4-diamine
CID 79117135
trans-(1R,2R)-2-[methyl-[(2-methylphenyl)methyl]amino]cyclopentan-1-ol
CID 102734447
2-methoxy-6-[[methyl-[4-(methylamino)cyclohexyl]amino]methyl]phenol
CID 79122393

Frequently Asked Questions

What is the IUPAC name of 1-N,3-N-dimethyl-3-N-[(2-methylphenyl)methyl]cyclopentane-1,3-diamine?
The IUPAC name of 1-N,3-N-dimethyl-3-N-[(2-methylphenyl)methyl]cyclopentane-1,3-diamine (CID 79643894) is 1-N,3-N-dimethyl-3-N-[(2-methylphenyl)methyl]cyclopentane-1,3-diamine.
What is the SMILES notation for 1-N,3-N-dimethyl-3-N-[(2-methylphenyl)methyl]cyclopentane-1,3-diamine?
The canonical SMILES for 1-N,3-N-dimethyl-3-N-[(2-methylphenyl)methyl]cyclopentane-1,3-diamine is CNC1CCC(N(C)Cc2ccccc2C)C1.
What is the InChIKey of 1-N,3-N-dimethyl-3-N-[(2-methylphenyl)methyl]cyclopentane-1,3-diamine?
The InChIKey is CEZDTPCIAMZDGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-12-6-4-5-7-13(12)11-17(3)15-9-8-14(10-15)16-2/h4-7,14-16H,8-11H2,1-3H3.
What are the key properties of 1-N,3-N-dimethyl-3-N-[(2-methylphenyl)methyl]cyclopentane-1,3-diamine?
1-N,3-N-dimethyl-3-N-[(2-methylphenyl)methyl]cyclopentane-1,3-diamine has a molecular weight of 232.37 g/mol, XLogP of 2.57, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,3-N-dimethyl-3-N-[(2-methylphenyl)methyl]cyclopentane-1,3-diamine is sourced from PubChem (CID 79643894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).