(Z)-1-[tert-butyl(hydrazinyl)amino]-3-methylbut-1-en-2-amine

C9H22N4 — CID 139297709

IUPAC(Z)-1-[tert-butyl(hydrazinyl)amino]-3-methylbut-1-en-2-amine
SMILESCC(C)/C(N)=C/N(NN)C(C)(C)C
InChIInChI=1S/C9H22N4/c1-7(2)8(10)6-13(12-11)9(3,4)5/h6-7,12H,10-11H2,1-5H3/b8-6-
InChIKeyQMAHWDBSIMPZCG-VURMDHGXSA-N
MW186.30 g/mol
LogP0.92
Rot. Bonds3

About (Z)-1-[tert-butyl(hydrazinyl)amino]-3-methylbut-1-en-2-amine

(Z)-1-[tert-butyl(hydrazinyl)amino]-3-methylbut-1-en-2-amine (PubChem CID 139297709) has the molecular formula C9H22N4 and a molecular weight of 186.30 g/mol. Its IUPAC name is (Z)-1-[tert-butyl(hydrazinyl)amino]-3-methylbut-1-en-2-amine.

Molecular Properties

Compound Name(Z)-1-[tert-butyl(hydrazinyl)amino]-3-methylbut-1-en-2-amine
PubChem CID139297709
Molecular FormulaC9H22N4
Molecular Weight186.30 g/mol
Exact Mass186.18
IUPAC Name(Z)-1-[tert-butyl(hydrazinyl)amino]-3-methylbut-1-en-2-amine
SMILESCC(C)/C(N)=C/N(NN)C(C)(C)C
InChIInChI=1S/C9H22N4/c1-7(2)8(10)6-13(12-11)9(3,4)5/h6-7,12H,10-11H2,1-5H3/b8-6-
InChIKeyQMAHWDBSIMPZCG-VURMDHGXSA-N
XLogP0.92
TPSA67.31 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-methylpent-2-en-3-amine
CID 72590374
4-methylpent-2-ene-1,3-diamine
CID 175534446
(Z)-2-amino-3-methylbut-1-ene-1-thiol
CID 88580233
N-[(Z)-1,3-diamino-4-methylpent-2-enylidene]formamide
CID 176713937
(Z)-1-[amino(propan-2-yl)amino]-3,3-difluoroprop-1-en-2-amine;ethane
CID 176699628
2-methyl-2-propan-2-ylpropanediamide
CID 45122126
(Z)-1-[amino(methyl)amino]-3-chlorobut-1-en-2-amine
CID 170098899
ethane;propan-2-amine;prop-1-en-2-amine
CID 162282667
(Z)-1-N,1-N-dimethylprop-1-ene-1,2-diamine
CID 88777001
2,3-dimethyl(213C)butan-2-ol
CID 100985919
N-tert-butyl-N-(cyclopropylmethyl)-2-methylpropanamide
CID 146435466
(2R)-2-amino-N-(1-cyclopropylpropan-2-yl)-3,3-dimethylbutanamide
CID 103929976

Frequently Asked Questions

What is the IUPAC name of (Z)-1-[tert-butyl(hydrazinyl)amino]-3-methylbut-1-en-2-amine?
The IUPAC name of (Z)-1-[tert-butyl(hydrazinyl)amino]-3-methylbut-1-en-2-amine (CID 139297709) is (Z)-1-[tert-butyl(hydrazinyl)amino]-3-methylbut-1-en-2-amine.
What is the SMILES notation for (Z)-1-[tert-butyl(hydrazinyl)amino]-3-methylbut-1-en-2-amine?
The canonical SMILES for (Z)-1-[tert-butyl(hydrazinyl)amino]-3-methylbut-1-en-2-amine is CC(C)/C(N)=C/N(NN)C(C)(C)C.
What is the InChIKey of (Z)-1-[tert-butyl(hydrazinyl)amino]-3-methylbut-1-en-2-amine?
The InChIKey is QMAHWDBSIMPZCG-VURMDHGXSA-N. The full InChI is InChI=1S/C9H22N4/c1-7(2)8(10)6-13(12-11)9(3,4)5/h6-7,12H,10-11H2,1-5H3/b8-6-.
What are the key properties of (Z)-1-[tert-butyl(hydrazinyl)amino]-3-methylbut-1-en-2-amine?
(Z)-1-[tert-butyl(hydrazinyl)amino]-3-methylbut-1-en-2-amine has a molecular weight of 186.30 g/mol, XLogP of 0.92, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-[tert-butyl(hydrazinyl)amino]-3-methylbut-1-en-2-amine is sourced from PubChem (CID 139297709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).