(Z)-N-ethyl-1-(prop-2-enylideneamino)-N-propylprop-1-en-1-amine

C11H20N2 — CID 174008881

IUPAC(Z)-N-ethyl-1-(prop-2-enylideneamino)-N-propylprop-1-en-1-amine
SMILESC=CC=N/C(=C\C)N(CC)CCC
InChIInChI=1S/C11H20N2/c1-5-9-12-11(7-3)13(8-4)10-6-2/h5,7,9H,1,6,8,10H2,2-4H3/b11-7+,12-9?
InChIKeyWTVYQYFCAGVLSB-IPYRJBSYSA-N
MW180.29 g/mol
LogP2.84
Rot. Bonds6

About (Z)-N-ethyl-1-(prop-2-enylideneamino)-N-propylprop-1-en-1-amine

(Z)-N-ethyl-1-(prop-2-enylideneamino)-N-propylprop-1-en-1-amine (PubChem CID 174008881) has the molecular formula C11H20N2 and a molecular weight of 180.29 g/mol. Its IUPAC name is (Z)-N-ethyl-1-(prop-2-enylideneamino)-N-propylprop-1-en-1-amine.

Molecular Properties

Compound Name(Z)-N-ethyl-1-(prop-2-enylideneamino)-N-propylprop-1-en-1-amine
PubChem CID174008881
Molecular FormulaC11H20N2
Molecular Weight180.29 g/mol
Exact Mass180.16
IUPAC Name(Z)-N-ethyl-1-(prop-2-enylideneamino)-N-propylprop-1-en-1-amine
SMILESC=CC=N/C(=C\C)N(CC)CCC
InChIInChI=1S/C11H20N2/c1-5-9-12-11(7-3)13(8-4)10-6-2/h5,7,9H,1,6,8,10H2,2-4H3/b11-7+,12-9?
InChIKeyWTVYQYFCAGVLSB-IPYRJBSYSA-N
XLogP2.84
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.29
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-butyl-3-methyl-2H-pyrimidin-3-ium
CID 17865359
1-ethyl-2H-pyrimidine
CID 22646239
1-propyl-2H-pyrimidine
CID 57218464
1-butyl-2H-pyrimidine
CID 57321656
3-(Diethylamino)prop-2-enylidene-diethylazanium
CID 58911991
1-pentyl-2H-pyrimidine
CID 66587415
1,2-dipentyl-2H-pyrimidine
CID 66633153
1-methyl-3-propyl-2H-pyrimidin-1-ium
CID 67276544
N-[1-(4-methylpiperazin-1-yl)ethenyl]prop-2-en-1-imine
CID 68309739
1,3-dipropyl-2H-pyrimidin-3-ium
CID 68982596
1,3-diethyl-2H-pyrimidin-3-ium
CID 68982778
1-ethyl-3-propyl-2H-pyrimidin-3-ium
CID 68984249

Frequently Asked Questions

What is the IUPAC name of (Z)-N-ethyl-1-(prop-2-enylideneamino)-N-propylprop-1-en-1-amine?
The IUPAC name of (Z)-N-ethyl-1-(prop-2-enylideneamino)-N-propylprop-1-en-1-amine (CID 174008881) is (Z)-N-ethyl-1-(prop-2-enylideneamino)-N-propylprop-1-en-1-amine.
What is the SMILES notation for (Z)-N-ethyl-1-(prop-2-enylideneamino)-N-propylprop-1-en-1-amine?
The canonical SMILES for (Z)-N-ethyl-1-(prop-2-enylideneamino)-N-propylprop-1-en-1-amine is C=CC=N/C(=C\C)N(CC)CCC.
What is the InChIKey of (Z)-N-ethyl-1-(prop-2-enylideneamino)-N-propylprop-1-en-1-amine?
The InChIKey is WTVYQYFCAGVLSB-IPYRJBSYSA-N. The full InChI is InChI=1S/C11H20N2/c1-5-9-12-11(7-3)13(8-4)10-6-2/h5,7,9H,1,6,8,10H2,2-4H3/b11-7+,12-9?.
What are the key properties of (Z)-N-ethyl-1-(prop-2-enylideneamino)-N-propylprop-1-en-1-amine?
(Z)-N-ethyl-1-(prop-2-enylideneamino)-N-propylprop-1-en-1-amine has a molecular weight of 180.29 g/mol, XLogP of 2.84, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-ethyl-1-(prop-2-enylideneamino)-N-propylprop-1-en-1-amine is sourced from PubChem (CID 174008881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).