(Z)-2-N-ethenyl-3-methoxy-2-N-(2-methylpropyl)prop-1-ene-1,2-diamine

C10H20N2O — CID 118221186

IUPAC(Z)-2-N-ethenyl-3-methoxy-2-N-(2-methylpropyl)prop-1-ene-1,2-diamine
SMILESC=CN(CC(C)C)/C(=C\N)COC
InChIInChI=1S/C10H20N2O/c1-5-12(7-9(2)3)10(6-11)8-13-4/h5-6,9H,1,7-8,11H2,2-4H3/b10-6-
InChIKeyADOHCOWAJBQKEW-POHAHGRESA-N
MW184.28 g/mol
LogP1.53
Rot. Bonds6

About (Z)-2-N-ethenyl-3-methoxy-2-N-(2-methylpropyl)prop-1-ene-1,2-diamine

(Z)-2-N-ethenyl-3-methoxy-2-N-(2-methylpropyl)prop-1-ene-1,2-diamine (PubChem CID 118221186) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is (Z)-2-N-ethenyl-3-methoxy-2-N-(2-methylpropyl)prop-1-ene-1,2-diamine.

Molecular Properties

Compound Name(Z)-2-N-ethenyl-3-methoxy-2-N-(2-methylpropyl)prop-1-ene-1,2-diamine
PubChem CID118221186
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name(Z)-2-N-ethenyl-3-methoxy-2-N-(2-methylpropyl)prop-1-ene-1,2-diamine
SMILESC=CN(CC(C)C)/C(=C\N)COC
InChIInChI=1S/C10H20N2O/c1-5-12(7-9(2)3)10(6-11)8-13-4/h5-6,9H,1,7-8,11H2,2-4H3/b10-6-
InChIKeyADOHCOWAJBQKEW-POHAHGRESA-N
XLogP1.53
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (Z)-2-N-ethenyl-3-methoxy-2-N-(2-methylpropyl)prop-1-ene-1,2-diamine?
The IUPAC name of (Z)-2-N-ethenyl-3-methoxy-2-N-(2-methylpropyl)prop-1-ene-1,2-diamine (CID 118221186) is (Z)-2-N-ethenyl-3-methoxy-2-N-(2-methylpropyl)prop-1-ene-1,2-diamine.
What is the SMILES notation for (Z)-2-N-ethenyl-3-methoxy-2-N-(2-methylpropyl)prop-1-ene-1,2-diamine?
The canonical SMILES for (Z)-2-N-ethenyl-3-methoxy-2-N-(2-methylpropyl)prop-1-ene-1,2-diamine is C=CN(CC(C)C)/C(=C\N)COC.
What is the InChIKey of (Z)-2-N-ethenyl-3-methoxy-2-N-(2-methylpropyl)prop-1-ene-1,2-diamine?
The InChIKey is ADOHCOWAJBQKEW-POHAHGRESA-N. The full InChI is InChI=1S/C10H20N2O/c1-5-12(7-9(2)3)10(6-11)8-13-4/h5-6,9H,1,7-8,11H2,2-4H3/b10-6-.
What are the key properties of (Z)-2-N-ethenyl-3-methoxy-2-N-(2-methylpropyl)prop-1-ene-1,2-diamine?
(Z)-2-N-ethenyl-3-methoxy-2-N-(2-methylpropyl)prop-1-ene-1,2-diamine has a molecular weight of 184.28 g/mol, XLogP of 1.53, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-N-ethenyl-3-methoxy-2-N-(2-methylpropyl)prop-1-ene-1,2-diamine is sourced from PubChem (CID 118221186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).