N,N-diamino-1,1-bis(4-methylphenyl)methanamine

C15H19N3 — CID 171061386

IUPACN,N-diamino-1,1-bis(4-methylphenyl)methanamine
SMILESCc1ccc(C(c2ccc(C)cc2)N(N)N)cc1
InChIInChI=1S/C15H19N3/c1-11-3-7-13(8-4-11)15(18(16)17)14-9-5-12(2)6-10-14/h3-10,15H,16-17H2,1-2H3
InChIKeyZYUYCLFLJMWPBB-UHFFFAOYSA-N
MW241.34 g/mol
LogP2.44
Rot. Bonds3

About N,N-diamino-1,1-bis(4-methylphenyl)methanamine

N,N-diamino-1,1-bis(4-methylphenyl)methanamine (PubChem CID 171061386) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is N,N-diamino-1,1-bis(4-methylphenyl)methanamine.

Molecular Properties

Compound NameN,N-diamino-1,1-bis(4-methylphenyl)methanamine
PubChem CID171061386
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC NameN,N-diamino-1,1-bis(4-methylphenyl)methanamine
SMILESCc1ccc(C(c2ccc(C)cc2)N(N)N)cc1
InChIInChI=1S/C15H19N3/c1-11-3-7-13(8-4-11)15(18(16)17)14-9-5-12(2)6-10-14/h3-10,15H,16-17H2,1-2H3
InChIKeyZYUYCLFLJMWPBB-UHFFFAOYSA-N
XLogP2.44
TPSA55.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N,N-dimethyl-1-(4-methylphenyl)-1-phenylmethanamine
CID 102196523
bromo-(4-methylphenyl)methanamine
CID 22286716
amino-(4-methylphenyl)methanol
CID 70304176
tris(1-methyl-4-propan-2-ylbenzene);dihydrochloride
CID 175503400
N-methyl-2-(4-methylphenyl)propanehydrazide
CID 116845714
CID 158402729
CID 158402729
(1S)-1-(4-methylphenyl)propan-1-amine
CID 7028357
1-methyl-4-propan-2-ylbenzene;ruthenium;dihydroiodide
CID 175953909
CID 143322905
CID 143322905
1-methyl-4-propan-2-ylbenzene;ruthenium(3+);triiodide
CID 175881712
1-methyl-4-propan-2-ylbenzene;ruthenium(2+);dichloride
CID 11551268
cobalt;bis(1,4-xylene)
CID 67859603

Frequently Asked Questions

What is the IUPAC name of N,N-diamino-1,1-bis(4-methylphenyl)methanamine?
The IUPAC name of N,N-diamino-1,1-bis(4-methylphenyl)methanamine (CID 171061386) is N,N-diamino-1,1-bis(4-methylphenyl)methanamine.
What is the SMILES notation for N,N-diamino-1,1-bis(4-methylphenyl)methanamine?
The canonical SMILES for N,N-diamino-1,1-bis(4-methylphenyl)methanamine is Cc1ccc(C(c2ccc(C)cc2)N(N)N)cc1.
What is the InChIKey of N,N-diamino-1,1-bis(4-methylphenyl)methanamine?
The InChIKey is ZYUYCLFLJMWPBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-11-3-7-13(8-4-11)15(18(16)17)14-9-5-12(2)6-10-14/h3-10,15H,16-17H2,1-2H3.
What are the key properties of N,N-diamino-1,1-bis(4-methylphenyl)methanamine?
N,N-diamino-1,1-bis(4-methylphenyl)methanamine has a molecular weight of 241.34 g/mol, XLogP of 2.44, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diamino-1,1-bis(4-methylphenyl)methanamine is sourced from PubChem (CID 171061386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).