(Z)-N,3-dimethyl-2-(methylideneamino)-N-propan-2-ylbut-1-en-1-amine

C10H20N2 — CID 139390534

IUPAC(Z)-N,3-dimethyl-2-(methylideneamino)-N-propan-2-ylbut-1-en-1-amine
SMILESC=N/C(=C\N(C)C(C)C)C(C)C
InChIInChI=1S/C10H20N2/c1-8(2)10(11-5)7-12(6)9(3)4/h7-9H,5H2,1-4,6H3/b10-7-
InChIKeyBPQFCCVUPWPYJO-YFHOEESVSA-N
MW168.28 g/mol
LogP2.52
Rot. Bonds4

About (Z)-N,3-dimethyl-2-(methylideneamino)-N-propan-2-ylbut-1-en-1-amine

(Z)-N,3-dimethyl-2-(methylideneamino)-N-propan-2-ylbut-1-en-1-amine (PubChem CID 139390534) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is (Z)-N,3-dimethyl-2-(methylideneamino)-N-propan-2-ylbut-1-en-1-amine.

Molecular Properties

Compound Name(Z)-N,3-dimethyl-2-(methylideneamino)-N-propan-2-ylbut-1-en-1-amine
PubChem CID139390534
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name(Z)-N,3-dimethyl-2-(methylideneamino)-N-propan-2-ylbut-1-en-1-amine
SMILESC=N/C(=C\N(C)C(C)C)C(C)C
InChIInChI=1S/C10H20N2/c1-8(2)10(11-5)7-12(6)9(3)4/h7-9H,5H2,1-4,6H3/b10-7-
InChIKeyBPQFCCVUPWPYJO-YFHOEESVSA-N
XLogP2.52
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.52
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

1,2-dimethyl-5-propan-2-yl-2H-pyrazine
CID 54204493
N-[(Z)-1-[amino(propan-2-yl)amino]-3-methylbut-1-en-2-yl]methanimine
CID 89084461
N-[(Z)-2-(ethylideneamino)-3-methylbut-1-enyl]ethanimine
CID 129101834
N,2-dimethyl-N-[(Z)-2-(methylideneamino)prop-1-enyl]propan-2-amine
CID 132045725
(Z)-N-methyl-2-(methylideneamino)-N-propan-2-ylprop-1-en-1-amine
CID 132122830
1,3-Di(propan-2-yl)pyrazine
CID 135212822
(Z)-N-tert-butyl-N,3,3-trimethyl-2-(methylideneamino)but-1-en-1-amine
CID 137465366
ethane;N-[(Z)-3-methyl-2-(methylideneamino)but-1-enyl]methanimine
CID 142430207
N-[(Z)-3-methyl-2-(methylideneamino)but-1-enyl]methanimine
CID 142430208
ethane;N-[(Z)-2-(methylideneamino)but-1-enyl]methanimine
CID 142915761
ethane;N-[(Z)-2-(methylideneamino)but-1-enyl]methanimine
CID 143985205
ethane;(Z)-N-ethyl-N-methyl-2-(methylideneamino)prop-1-en-1-amine
CID 144474065

Frequently Asked Questions

What is the IUPAC name of (Z)-N,3-dimethyl-2-(methylideneamino)-N-propan-2-ylbut-1-en-1-amine?
The IUPAC name of (Z)-N,3-dimethyl-2-(methylideneamino)-N-propan-2-ylbut-1-en-1-amine (CID 139390534) is (Z)-N,3-dimethyl-2-(methylideneamino)-N-propan-2-ylbut-1-en-1-amine.
What is the SMILES notation for (Z)-N,3-dimethyl-2-(methylideneamino)-N-propan-2-ylbut-1-en-1-amine?
The canonical SMILES for (Z)-N,3-dimethyl-2-(methylideneamino)-N-propan-2-ylbut-1-en-1-amine is C=N/C(=C\N(C)C(C)C)C(C)C.
What is the InChIKey of (Z)-N,3-dimethyl-2-(methylideneamino)-N-propan-2-ylbut-1-en-1-amine?
The InChIKey is BPQFCCVUPWPYJO-YFHOEESVSA-N. The full InChI is InChI=1S/C10H20N2/c1-8(2)10(11-5)7-12(6)9(3)4/h7-9H,5H2,1-4,6H3/b10-7-.
What are the key properties of (Z)-N,3-dimethyl-2-(methylideneamino)-N-propan-2-ylbut-1-en-1-amine?
(Z)-N,3-dimethyl-2-(methylideneamino)-N-propan-2-ylbut-1-en-1-amine has a molecular weight of 168.28 g/mol, XLogP of 2.52, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N,3-dimethyl-2-(methylideneamino)-N-propan-2-ylbut-1-en-1-amine is sourced from PubChem (CID 139390534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).