2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]-1-(4-methylphenyl)-1-N-propylpropane-1,2-diamine

C19H32N2 — CID 63866567

IUPAC2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]-1-(4-methylphenyl)-1-N-propylpropane-1,2-diamine
SMILESCCCNC(c1ccc(C)cc1)C(C)N(C)CC1CC1C
InChIInChI=1S/C19H32N2/c1-6-11-20-19(17-9-7-14(2)8-10-17)16(4)21(5)13-18-12-15(18)3/h7-10,15-16,18-20H,6,11-13H2,1-5H3
InChIKeyNHMQAGJADNFZFC-UHFFFAOYSA-N
MW288.48 g/mol
LogP4.01
Rot. Bonds8

About 2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]-1-(4-methylphenyl)-1-N-propylpropane-1,2-diamine

2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]-1-(4-methylphenyl)-1-N-propylpropane-1,2-diamine (PubChem CID 63866567) has the molecular formula C19H32N2 and a molecular weight of 288.48 g/mol. Its IUPAC name is 2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]-1-(4-methylphenyl)-1-N-propylpropane-1,2-diamine.

Molecular Properties

Compound Name2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]-1-(4-methylphenyl)-1-N-propylpropane-1,2-diamine
PubChem CID63866567
Molecular FormulaC19H32N2
Molecular Weight288.48 g/mol
Exact Mass288.26
IUPAC Name2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]-1-(4-methylphenyl)-1-N-propylpropane-1,2-diamine
SMILESCCCNC(c1ccc(C)cc1)C(C)N(C)CC1CC1C
InChIInChI=1S/C19H32N2/c1-6-11-20-19(17-9-7-14(2)8-10-17)16(4)21(5)13-18-12-15(18)3/h7-10,15-16,18-20H,6,11-13H2,1-5H3
InChIKeyNHMQAGJADNFZFC-UHFFFAOYSA-N
XLogP4.01
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.48
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-N-(2,2-dimethylpropyl)-2-N-methyl-1-(4-methylphenyl)-1-N-propylpropane-1,2-diamine
CID 63468182
1-(4-ethylphenyl)-2-[methyl-[(2-methylcyclopropyl)methyl]amino]propan-1-ol
CID 63864319
2-N-butyl-1-(4-ethylphenyl)-2-N-methyl-1-N-propylpropane-1,2-diamine
CID 63465492
1-(4-methylphenyl)-2-methylsulfinyl-N-propylpropan-1-amine
CID 64655218
3-N-methyl-3-N-[(2-methylcyclopropyl)methyl]-4-N-propylheptane-3,4-diamine
CID 55258814
2-(cyclopentylmethylsulfanyl)-1-(4-methylphenyl)-N-propylpropan-1-amine
CID 64627775
N-[(3,4-dimethylcyclohexyl)-(4-methylphenyl)methyl]propan-1-amine
CID 64740428
2-N,3-N-dimethyl-3-N-[(2-methylcyclopropyl)methyl]butane-2,3-diamine
CID 63880301
3-N-methyl-3-N-[(2-methylcyclopropyl)methyl]butane-2,3-diamine
CID 63878750
5-bromo-N-methyl-N-[(2-methylcyclopropyl)methyl]-2-[1-(propylamino)ethyl]aniline
CID 82968453
N,N-dimethyl-1-[(4-methylphenyl)-(propylamino)methyl]cyclopentan-1-amine
CID 79070156
2-ethoxy-1-(4-methylphenyl)-N-propylpentan-1-amine
CID 116718350

Frequently Asked Questions

What is the IUPAC name of 2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]-1-(4-methylphenyl)-1-N-propylpropane-1,2-diamine?
The IUPAC name of 2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]-1-(4-methylphenyl)-1-N-propylpropane-1,2-diamine (CID 63866567) is 2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]-1-(4-methylphenyl)-1-N-propylpropane-1,2-diamine.
What is the SMILES notation for 2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]-1-(4-methylphenyl)-1-N-propylpropane-1,2-diamine?
The canonical SMILES for 2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]-1-(4-methylphenyl)-1-N-propylpropane-1,2-diamine is CCCNC(c1ccc(C)cc1)C(C)N(C)CC1CC1C.
What is the InChIKey of 2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]-1-(4-methylphenyl)-1-N-propylpropane-1,2-diamine?
The InChIKey is NHMQAGJADNFZFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N2/c1-6-11-20-19(17-9-7-14(2)8-10-17)16(4)21(5)13-18-12-15(18)3/h7-10,15-16,18-20H,6,11-13H2,1-5H3.
What are the key properties of 2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]-1-(4-methylphenyl)-1-N-propylpropane-1,2-diamine?
2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]-1-(4-methylphenyl)-1-N-propylpropane-1,2-diamine has a molecular weight of 288.48 g/mol, XLogP of 4.01, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]-1-(4-methylphenyl)-1-N-propylpropane-1,2-diamine is sourced from PubChem (CID 63866567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).