(Z)-3-amino-N,2-dipropylhex-2-enamide

C12H24N2O — CID 23183834

IUPAC(Z)-3-amino-N,2-dipropylhex-2-enamide
SMILESCCCNC(=O)/C(CCC)=C(\N)CCC
InChIInChI=1S/C12H24N2O/c1-4-7-10(11(13)8-5-2)12(15)14-9-6-3/h4-9,13H2,1-3H3,(H,14,15)/b11-10-
InChIKeyAMLNRWHVZFPKAA-KHPPLWFESA-N
MW212.34 g/mol
LogP2.33
Rot. Bonds7

About (Z)-3-amino-N,2-dipropylhex-2-enamide

(Z)-3-amino-N,2-dipropylhex-2-enamide (PubChem CID 23183834) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is (Z)-3-amino-N,2-dipropylhex-2-enamide.

Molecular Properties

Compound Name(Z)-3-amino-N,2-dipropylhex-2-enamide
PubChem CID23183834
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name(Z)-3-amino-N,2-dipropylhex-2-enamide
SMILESCCCNC(=O)/C(CCC)=C(\N)CCC
InChIInChI=1S/C12H24N2O/c1-4-7-10(11(13)8-5-2)12(15)14-9-6-3/h4-9,13H2,1-3H3,(H,14,15)/b11-10-
InChIKeyAMLNRWHVZFPKAA-KHPPLWFESA-N
XLogP2.33
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 52.33
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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Frequently Asked Questions

What is the IUPAC name of (Z)-3-amino-N,2-dipropylhex-2-enamide?
The IUPAC name of (Z)-3-amino-N,2-dipropylhex-2-enamide (CID 23183834) is (Z)-3-amino-N,2-dipropylhex-2-enamide.
What is the SMILES notation for (Z)-3-amino-N,2-dipropylhex-2-enamide?
The canonical SMILES for (Z)-3-amino-N,2-dipropylhex-2-enamide is CCCNC(=O)/C(CCC)=C(\N)CCC.
What is the InChIKey of (Z)-3-amino-N,2-dipropylhex-2-enamide?
The InChIKey is AMLNRWHVZFPKAA-KHPPLWFESA-N. The full InChI is InChI=1S/C12H24N2O/c1-4-7-10(11(13)8-5-2)12(15)14-9-6-3/h4-9,13H2,1-3H3,(H,14,15)/b11-10-.
What are the key properties of (Z)-3-amino-N,2-dipropylhex-2-enamide?
(Z)-3-amino-N,2-dipropylhex-2-enamide has a molecular weight of 212.34 g/mol, XLogP of 2.33, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-amino-N,2-dipropylhex-2-enamide is sourced from PubChem (CID 23183834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).