N-[1-[(Z)-2-methylprop-2-enylideneamino]ethenyl]pentan-3-amine

C11H20N2 — CID 143011667

IUPACN-[1-[(Z)-2-methylprop-2-enylideneamino]ethenyl]pentan-3-amine
SMILESC=C(C)/C=N\C(=C)NC(CC)CC
InChIInChI=1S/C11H20N2/c1-6-11(7-2)13-10(5)12-8-9(3)4/h8,11,13H,3,5-7H2,1-2,4H3/b12-8-
InChIKeyLIFJBZFFPXRZGX-WQLSENKSSA-N
MW180.29 g/mol
LogP2.88
Rot. Bonds6

About N-[1-[(Z)-2-methylprop-2-enylideneamino]ethenyl]pentan-3-amine

N-[1-[(Z)-2-methylprop-2-enylideneamino]ethenyl]pentan-3-amine (PubChem CID 143011667) has the molecular formula C11H20N2 and a molecular weight of 180.29 g/mol. Its IUPAC name is N-[1-[(Z)-2-methylprop-2-enylideneamino]ethenyl]pentan-3-amine.

Molecular Properties

Compound NameN-[1-[(Z)-2-methylprop-2-enylideneamino]ethenyl]pentan-3-amine
PubChem CID143011667
Molecular FormulaC11H20N2
Molecular Weight180.29 g/mol
Exact Mass180.16
IUPAC NameN-[1-[(Z)-2-methylprop-2-enylideneamino]ethenyl]pentan-3-amine
SMILESC=C(C)/C=N\C(=C)NC(CC)CC
InChIInChI=1S/C11H20N2/c1-6-11(7-2)13-10(5)12-8-9(3)4/h8,11,13H,3,5-7H2,1-2,4H3/b12-8-
InChIKeyLIFJBZFFPXRZGX-WQLSENKSSA-N
XLogP2.88
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.29
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

(Z)-2-methyl-3-methylimino-N-propan-2-ylprop-1-en-1-amine
CID 89400069
N,N'-dimethyl-N'-[1-[(Z)-2-methylprop-2-enylideneamino]ethenyl]ethane-1,2-diamine
CID 143011684
N-[1-[(Z)-2-methylprop-2-enylideneamino]ethenyl]propan-1-amine
CID 143767968
N-[1-[(Z)-[(Z)-2-methylbut-2-enylidene]amino]ethenyl]butan-1-amine
CID 144304446
3,5-dimethyl-N-propan-2-yl-2H-1,3-azaborinin-2-amine
CID 144342230
ethane;N-ethyl-1-[(Z)-2-methylprop-2-enylideneamino]ethenamine;propane
CID 168223633
N-ethyl-1-[(Z)-2-methylprop-2-enylideneamino]ethenamine
CID 168223634

Frequently Asked Questions

What is the IUPAC name of N-[1-[(Z)-2-methylprop-2-enylideneamino]ethenyl]pentan-3-amine?
The IUPAC name of N-[1-[(Z)-2-methylprop-2-enylideneamino]ethenyl]pentan-3-amine (CID 143011667) is N-[1-[(Z)-2-methylprop-2-enylideneamino]ethenyl]pentan-3-amine.
What is the SMILES notation for N-[1-[(Z)-2-methylprop-2-enylideneamino]ethenyl]pentan-3-amine?
The canonical SMILES for N-[1-[(Z)-2-methylprop-2-enylideneamino]ethenyl]pentan-3-amine is C=C(C)/C=N\C(=C)NC(CC)CC.
What is the InChIKey of N-[1-[(Z)-2-methylprop-2-enylideneamino]ethenyl]pentan-3-amine?
The InChIKey is LIFJBZFFPXRZGX-WQLSENKSSA-N. The full InChI is InChI=1S/C11H20N2/c1-6-11(7-2)13-10(5)12-8-9(3)4/h8,11,13H,3,5-7H2,1-2,4H3/b12-8-.
What are the key properties of N-[1-[(Z)-2-methylprop-2-enylideneamino]ethenyl]pentan-3-amine?
N-[1-[(Z)-2-methylprop-2-enylideneamino]ethenyl]pentan-3-amine has a molecular weight of 180.29 g/mol, XLogP of 2.88, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(Z)-2-methylprop-2-enylideneamino]ethenyl]pentan-3-amine is sourced from PubChem (CID 143011667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).