N-[(Z)-1-[amino(propan-2-yl)amino]-3,3-dimethylbut-1-en-2-yl]methanimine

C10H21N3 — CID 146213851

IUPACN-[(Z)-1-[amino(propan-2-yl)amino]-3,3-dimethylbut-1-en-2-yl]methanimine
SMILESC=N/C(=C\N(N)C(C)C)C(C)(C)C
InChIInChI=1S/C10H21N3/c1-8(2)13(11)7-9(12-6)10(3,4)5/h7-8H,6,11H2,1-5H3/b9-7-
InChIKeyGLPGAMNNMVIOFN-CLFYSBASSA-N
MW183.30 g/mol
LogP2.16
Rot. Bonds3

About N-[(Z)-1-[amino(propan-2-yl)amino]-3,3-dimethylbut-1-en-2-yl]methanimine

N-[(Z)-1-[amino(propan-2-yl)amino]-3,3-dimethylbut-1-en-2-yl]methanimine (PubChem CID 146213851) has the molecular formula C10H21N3 and a molecular weight of 183.30 g/mol. Its IUPAC name is N-[(Z)-1-[amino(propan-2-yl)amino]-3,3-dimethylbut-1-en-2-yl]methanimine.

Molecular Properties

Compound NameN-[(Z)-1-[amino(propan-2-yl)amino]-3,3-dimethylbut-1-en-2-yl]methanimine
PubChem CID146213851
Molecular FormulaC10H21N3
Molecular Weight183.30 g/mol
Exact Mass183.17
IUPAC NameN-[(Z)-1-[amino(propan-2-yl)amino]-3,3-dimethylbut-1-en-2-yl]methanimine
SMILESC=N/C(=C\N(N)C(C)C)C(C)(C)C
InChIInChI=1S/C10H21N3/c1-8(2)13(11)7-9(12-6)10(3,4)5/h7-8H,6,11H2,1-5H3/b9-7-
InChIKeyGLPGAMNNMVIOFN-CLFYSBASSA-N
XLogP2.16
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.30
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(Z)-1-[amino(propan-2-yl)amino]-3,3-difluoroprop-1-en-2-amine
CID 156637586
(Z)-1-[amino(propan-2-yl)amino]-3,3-difluoroprop-1-en-2-amine;ethane
CID 176699628
N-[(3Z,5Z)-2,2-dimethylhepta-3,5-dien-3-yl]methanimine
CID 126494567
(Z)-1-N,3,3-trimethyl-1-N-(methylideneamino)but-1-ene-1,2-diamine
CID 170021824
(Z)-2-methyl-3-(methylideneamino)pent-3-en-2-ol
CID 144712771
(Z)-1-[amino(propan-2-yl)amino]-3-methoxyprop-1-en-2-amine
CID 171786537
(Z)-1-[amino(propan-2-yl)amino]-3-propan-2-yloxyprop-1-en-2-amine
CID 178050350
N-[(Z)-1-[amino(methyl)amino]prop-1-en-2-yl]methanimine
CID 90369842
1-propan-2-yl-1-[(Z)-prop-1-enyl]hydrazine
CID 139357350
N,N-diamino-2,3-dimethyl-3-(methylideneamino)butan-2-amine
CID 163872694
2,2,2-trifluoro-N-methylideneacetamide
CID 23191452
CID 166497862
CID 166497862

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-1-[amino(propan-2-yl)amino]-3,3-dimethylbut-1-en-2-yl]methanimine?
The IUPAC name of N-[(Z)-1-[amino(propan-2-yl)amino]-3,3-dimethylbut-1-en-2-yl]methanimine (CID 146213851) is N-[(Z)-1-[amino(propan-2-yl)amino]-3,3-dimethylbut-1-en-2-yl]methanimine.
What is the SMILES notation for N-[(Z)-1-[amino(propan-2-yl)amino]-3,3-dimethylbut-1-en-2-yl]methanimine?
The canonical SMILES for N-[(Z)-1-[amino(propan-2-yl)amino]-3,3-dimethylbut-1-en-2-yl]methanimine is C=N/C(=C\N(N)C(C)C)C(C)(C)C.
What is the InChIKey of N-[(Z)-1-[amino(propan-2-yl)amino]-3,3-dimethylbut-1-en-2-yl]methanimine?
The InChIKey is GLPGAMNNMVIOFN-CLFYSBASSA-N. The full InChI is InChI=1S/C10H21N3/c1-8(2)13(11)7-9(12-6)10(3,4)5/h7-8H,6,11H2,1-5H3/b9-7-.
What are the key properties of N-[(Z)-1-[amino(propan-2-yl)amino]-3,3-dimethylbut-1-en-2-yl]methanimine?
N-[(Z)-1-[amino(propan-2-yl)amino]-3,3-dimethylbut-1-en-2-yl]methanimine has a molecular weight of 183.30 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-1-[amino(propan-2-yl)amino]-3,3-dimethylbut-1-en-2-yl]methanimine is sourced from PubChem (CID 146213851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).