2-N-methyl-2-N-(3-methylbutyl)prop-2-ene-1,2-diamine

C9H20N2 — CID 134572260

IUPAC2-N-methyl-2-N-(3-methylbutyl)prop-2-ene-1,2-diamine
SMILESC=C(CN)N(C)CCC(C)C
InChIInChI=1S/C9H20N2/c1-8(2)5-6-11(4)9(3)7-10/h8H,3,5-7,10H2,1-2,4H3
InChIKeyUMZGYGJVUCTVNB-UHFFFAOYSA-N
MW156.27 g/mol
LogP1.44
Rot. Bonds5

About 2-N-methyl-2-N-(3-methylbutyl)prop-2-ene-1,2-diamine

2-N-methyl-2-N-(3-methylbutyl)prop-2-ene-1,2-diamine (PubChem CID 134572260) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is 2-N-methyl-2-N-(3-methylbutyl)prop-2-ene-1,2-diamine.

Molecular Properties

Compound Name2-N-methyl-2-N-(3-methylbutyl)prop-2-ene-1,2-diamine
PubChem CID134572260
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC Name2-N-methyl-2-N-(3-methylbutyl)prop-2-ene-1,2-diamine
SMILESC=C(CN)N(C)CCC(C)C
InChIInChI=1S/C9H20N2/c1-8(2)5-6-11(4)9(3)7-10/h8H,3,5-7,10H2,1-2,4H3
InChIKeyUMZGYGJVUCTVNB-UHFFFAOYSA-N
XLogP1.44
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-methyl-1-(3-methylbutyl)thiourea
CID 61428905
N-ethyl-N,5-dimethylhex-1-en-2-amine
CID 89100834
ethane;ethyl N-methyl-N-(3-methylbutyl)carbamate
CID 168940776
2-cyano-2-ethyl-N-methyl-N-(3-methylbutyl)butanamide
CID 55208122
N'-cyclopropyl-N'-(3-methylbutyl)-2-methylidenepropane-1,3-diamine
CID 103070075
1,3-dimethyl-1-(3-methylbutyl)-3-propan-2-ylurea
CID 159273198
ethane;methanamine;N,N,3-trimethylbutan-1-amine
CID 143170086
2-N,2-dimethyl-2-N-(3-methylbutyl)propane-1,2-diamine
CID 61425411
2-amino-N-methyl-N-(3-methylbutyl)pentanamide
CID 60963800
N'-methyl-N'-(4-methylpentyl)propane-1,3-diamine
CID 59817423
3-chloro-N,2-dimethyl-N-(3-methylbutyl)propanamide
CID 62728337
2,2,2-trifluoroethyl N-methyl-N-(3-methylbutyl)carbamate
CID 61066672

Frequently Asked Questions

What is the IUPAC name of 2-N-methyl-2-N-(3-methylbutyl)prop-2-ene-1,2-diamine?
The IUPAC name of 2-N-methyl-2-N-(3-methylbutyl)prop-2-ene-1,2-diamine (CID 134572260) is 2-N-methyl-2-N-(3-methylbutyl)prop-2-ene-1,2-diamine.
What is the SMILES notation for 2-N-methyl-2-N-(3-methylbutyl)prop-2-ene-1,2-diamine?
The canonical SMILES for 2-N-methyl-2-N-(3-methylbutyl)prop-2-ene-1,2-diamine is C=C(CN)N(C)CCC(C)C.
What is the InChIKey of 2-N-methyl-2-N-(3-methylbutyl)prop-2-ene-1,2-diamine?
The InChIKey is UMZGYGJVUCTVNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2/c1-8(2)5-6-11(4)9(3)7-10/h8H,3,5-7,10H2,1-2,4H3.
What are the key properties of 2-N-methyl-2-N-(3-methylbutyl)prop-2-ene-1,2-diamine?
2-N-methyl-2-N-(3-methylbutyl)prop-2-ene-1,2-diamine has a molecular weight of 156.27 g/mol, XLogP of 1.44, 5 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-(3-methylbutyl)prop-2-ene-1,2-diamine is sourced from PubChem (CID 134572260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).