(Z)-2-methyl-3-(propylamino)hex-2-enamide

C10H20N2O — CID 87503829

IUPAC(Z)-2-methyl-3-(propylamino)hex-2-enamide
SMILESCCCN/C(CCC)=C(/C)C(N)=O
InChIInChI=1S/C10H20N2O/c1-4-6-9(12-7-5-2)8(3)10(11)13/h12H,4-7H2,1-3H3,(H2,11,13)/b9-8-
InChIKeyNDGRIZWUYAQDNO-HJWRWDBZSA-N
MW184.28 g/mol
LogP1.55
Rot. Bonds6

About (Z)-2-methyl-3-(propylamino)hex-2-enamide

(Z)-2-methyl-3-(propylamino)hex-2-enamide (PubChem CID 87503829) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is (Z)-2-methyl-3-(propylamino)hex-2-enamide.

Molecular Properties

Compound Name(Z)-2-methyl-3-(propylamino)hex-2-enamide
PubChem CID87503829
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name(Z)-2-methyl-3-(propylamino)hex-2-enamide
SMILESCCCN/C(CCC)=C(/C)C(N)=O
InChIInChI=1S/C10H20N2O/c1-4-6-9(12-7-5-2)8(3)10(11)13/h12H,4-7H2,1-3H3,(H2,11,13)/b9-8-
InChIKeyNDGRIZWUYAQDNO-HJWRWDBZSA-N
XLogP1.55
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

(Z)-3-(dimethylamino)-2-methylhex-2-enamide
CID 17903381
(E)-3-(ethylamino)-2,5,5-trimethylhex-2-enamide
CID 17968385
(Z)-2-methyl-3-(methylamino)pent-2-enamide
CID 19089595
(Z)-3-(dimethylamino)-2-methylhept-2-enamide
CID 19089600
(E)-3-(diethylamino)-2,4-dimethylpent-2-enamide
CID 20281324
(E)-3-(dipropylamino)-2-methylpent-2-enamide
CID 21256418
(E)-3-amino-2-ethyl-N-propylpent-2-enamide
CID 21652620
(Z)-3-(diethylamino)-2-methylhept-2-enamide
CID 21653836
(E)-3-amino-N-butyl-2-ethylpent-2-enamide
CID 21693058
3,7-Dimethyl-2-propan-2-yl-1,5-dihydropyrrolo[3,2-c]pyridin-6-one
CID 22091765
(Z)-3-(diethylamino)-2-methylhex-2-enamide
CID 22227457
(Z)-3-(diethylamino)-2-methylpent-2-enamide
CID 23174709

Frequently Asked Questions

What is the IUPAC name of (Z)-2-methyl-3-(propylamino)hex-2-enamide?
The IUPAC name of (Z)-2-methyl-3-(propylamino)hex-2-enamide (CID 87503829) is (Z)-2-methyl-3-(propylamino)hex-2-enamide.
What is the SMILES notation for (Z)-2-methyl-3-(propylamino)hex-2-enamide?
The canonical SMILES for (Z)-2-methyl-3-(propylamino)hex-2-enamide is CCCN/C(CCC)=C(/C)C(N)=O.
What is the InChIKey of (Z)-2-methyl-3-(propylamino)hex-2-enamide?
The InChIKey is NDGRIZWUYAQDNO-HJWRWDBZSA-N. The full InChI is InChI=1S/C10H20N2O/c1-4-6-9(12-7-5-2)8(3)10(11)13/h12H,4-7H2,1-3H3,(H2,11,13)/b9-8-.
What are the key properties of (Z)-2-methyl-3-(propylamino)hex-2-enamide?
(Z)-2-methyl-3-(propylamino)hex-2-enamide has a molecular weight of 184.28 g/mol, XLogP of 1.55, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-methyl-3-(propylamino)hex-2-enamide is sourced from PubChem (CID 87503829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).