2-methyl-2-N-phenylpentane-1,2-diamine

C12H20N2 — CID 65379502

IUPAC2-methyl-2-N-phenylpentane-1,2-diamine
SMILESCCCC(C)(CN)Nc1ccccc1
InChIInChI=1S/C12H20N2/c1-3-9-12(2,10-13)14-11-7-5-4-6-8-11/h4-8,14H,3,9-10,13H2,1-2H3
InChIKeyACYUPNKKMDBZCS-UHFFFAOYSA-N
MW192.31 g/mol
LogP2.62
Rot. Bonds5

About 2-methyl-2-N-phenylpentane-1,2-diamine

2-methyl-2-N-phenylpentane-1,2-diamine (PubChem CID 65379502) has the molecular formula C12H20N2 and a molecular weight of 192.31 g/mol. Its IUPAC name is 2-methyl-2-N-phenylpentane-1,2-diamine.

Molecular Properties

Compound Name2-methyl-2-N-phenylpentane-1,2-diamine
PubChem CID65379502
Molecular FormulaC12H20N2
Molecular Weight192.31 g/mol
Exact Mass192.16
IUPAC Name2-methyl-2-N-phenylpentane-1,2-diamine
SMILESCCCC(C)(CN)Nc1ccccc1
InChIInChI=1S/C12H20N2/c1-3-9-12(2,10-13)14-11-7-5-4-6-8-11/h4-8,14H,3,9-10,13H2,1-2H3
InChIKeyACYUPNKKMDBZCS-UHFFFAOYSA-N
XLogP2.62
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.31
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-anilino-2-methylpentan-1-ol
CID 61046243
N-(4-methyldecan-4-yl)aniline
CID 166741267
2-methyl-2-N-(2-methylphenyl)pentane-1,2-diamine
CID 65377999
4-(aminomethyl)-N-(3-methylhexan-3-yl)aniline
CID 174182706
2-methyl-2-N-(4-methylphenyl)octane-1,2-diamine
CID 65377345
2-N-(4-fluorophenyl)-2-methylheptane-1,2-diamine
CID 80557635
2-anilino-2-methylpentanoic acid
CID 60992039
4-anilino-4-methylhexanoic acid
CID 70438970
2-methyl-2-N-pyridin-4-ylbutane-1,2-diamine
CID 64549693
2-N-(4-bromophenyl)-2-methylbutane-1,2-diamine
CID 65385972
N-(2-methyltridecan-2-yl)aniline
CID 67784312
4-methoxy-2-methyl-2-N-(4-methylphenyl)butane-1,2-diamine
CID 65376497

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-N-phenylpentane-1,2-diamine?
The IUPAC name of 2-methyl-2-N-phenylpentane-1,2-diamine (CID 65379502) is 2-methyl-2-N-phenylpentane-1,2-diamine.
What is the SMILES notation for 2-methyl-2-N-phenylpentane-1,2-diamine?
The canonical SMILES for 2-methyl-2-N-phenylpentane-1,2-diamine is CCCC(C)(CN)Nc1ccccc1.
What is the InChIKey of 2-methyl-2-N-phenylpentane-1,2-diamine?
The InChIKey is ACYUPNKKMDBZCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2/c1-3-9-12(2,10-13)14-11-7-5-4-6-8-11/h4-8,14H,3,9-10,13H2,1-2H3.
What are the key properties of 2-methyl-2-N-phenylpentane-1,2-diamine?
2-methyl-2-N-phenylpentane-1,2-diamine has a molecular weight of 192.31 g/mol, XLogP of 2.62, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-N-phenylpentane-1,2-diamine is sourced from PubChem (CID 65379502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).