N'-ethyl-N'-methyl-N-(2-methylidenebutyl)ethane-1,2-diamine

C10H22N2 — CID 66046180

IUPACN'-ethyl-N'-methyl-N-(2-methylidenebutyl)ethane-1,2-diamine
SMILESC=C(CC)CNCCN(C)CC
InChIInChI=1S/C10H22N2/c1-5-10(3)9-11-7-8-12(4)6-2/h11H,3,5-9H2,1-2,4H3
InChIKeyMIPRCRUKXYDEGG-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.49
Rot. Bonds7

About N'-ethyl-N'-methyl-N-(2-methylidenebutyl)ethane-1,2-diamine

N'-ethyl-N'-methyl-N-(2-methylidenebutyl)ethane-1,2-diamine (PubChem CID 66046180) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is N'-ethyl-N'-methyl-N-(2-methylidenebutyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-ethyl-N'-methyl-N-(2-methylidenebutyl)ethane-1,2-diamine
PubChem CID66046180
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC NameN'-ethyl-N'-methyl-N-(2-methylidenebutyl)ethane-1,2-diamine
SMILESC=C(CC)CNCCN(C)CC
InChIInChI=1S/C10H22N2/c1-5-10(3)9-11-7-8-12(4)6-2/h11H,3,5-9H2,1-2,4H3
InChIKeyMIPRCRUKXYDEGG-UHFFFAOYSA-N
XLogP1.49
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N'-ethyl-N'-methyl-N-(2-methylprop-2-enyl)ethane-1,2-diamine
CID 62635241
2-[2-[ethyl(methyl)amino]ethylamino]-N,N-dimethylacetamide
CID 62640483
N-but-1-en-2-yl-N'-ethyl-N'-methylethane-1,2-diamine
CID 176941787
N'-methyl-N-(2-methylidenebutyl)-N'-propan-2-ylbutane-1,4-diamine
CID 66047604
N-(2,3-dichloroprop-2-enyl)-N'-ethyl-N'-methylethane-1,2-diamine
CID 79168321
2-[methyl-[2-(propylaminomethyl)prop-2-enyl]amino]ethanol
CID 103069520
N-ethyl-N-methyl-3-methylidenehexan-1-amine
CID 126728192
N-butyl-2-[2-[2-[ethyl(methyl)amino]ethyl-methylamino]ethylamino]acetamide
CID 87733157
N-[2-(2-methylidenebutylamino)ethyl]methanesulfonamide
CID 66047591
methyl 3-(2-methylidenebutylamino)propanoate
CID 66045929
N-[2-[ethyl(methyl)amino]ethyl]-2-methylprop-2-enamide
CID 18414873
ethane;N'-ethyl-N,N'-dimethylethane-1,2-diamine;methanol
CID 144534922

Frequently Asked Questions

What is the IUPAC name of N'-ethyl-N'-methyl-N-(2-methylidenebutyl)ethane-1,2-diamine?
The IUPAC name of N'-ethyl-N'-methyl-N-(2-methylidenebutyl)ethane-1,2-diamine (CID 66046180) is N'-ethyl-N'-methyl-N-(2-methylidenebutyl)ethane-1,2-diamine.
What is the SMILES notation for N'-ethyl-N'-methyl-N-(2-methylidenebutyl)ethane-1,2-diamine?
The canonical SMILES for N'-ethyl-N'-methyl-N-(2-methylidenebutyl)ethane-1,2-diamine is C=C(CC)CNCCN(C)CC.
What is the InChIKey of N'-ethyl-N'-methyl-N-(2-methylidenebutyl)ethane-1,2-diamine?
The InChIKey is MIPRCRUKXYDEGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c1-5-10(3)9-11-7-8-12(4)6-2/h11H,3,5-9H2,1-2,4H3.
What are the key properties of N'-ethyl-N'-methyl-N-(2-methylidenebutyl)ethane-1,2-diamine?
N'-ethyl-N'-methyl-N-(2-methylidenebutyl)ethane-1,2-diamine has a molecular weight of 170.30 g/mol, XLogP of 1.49, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-N'-methyl-N-(2-methylidenebutyl)ethane-1,2-diamine is sourced from PubChem (CID 66046180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).