(Z)-3-methoxy-2-methylprop-2-en-1-amine

C5H11NO — CID 171800320

IUPAC(Z)-3-methoxy-2-methylprop-2-en-1-amine
SMILESCO/C=C(/C)CN
InChIInChI=1S/C5H11NO/c1-5(3-6)4-7-2/h4H,3,6H2,1-2H3/b5-4-
InChIKeyIQKSTQJKSUJPSA-PLNGDYQASA-N
MW101.15 g/mol
LogP0.50
Rot. Bonds2

About (Z)-3-methoxy-2-methylprop-2-en-1-amine

(Z)-3-methoxy-2-methylprop-2-en-1-amine (PubChem CID 171800320) has the molecular formula C5H11NO and a molecular weight of 101.15 g/mol. Its IUPAC name is (Z)-3-methoxy-2-methylprop-2-en-1-amine.

Molecular Properties

Compound Name(Z)-3-methoxy-2-methylprop-2-en-1-amine
PubChem CID171800320
Molecular FormulaC5H11NO
Molecular Weight101.15 g/mol
Exact Mass101.08
IUPAC Name(Z)-3-methoxy-2-methylprop-2-en-1-amine
SMILESCO/C=C(/C)CN
InChIInChI=1S/C5H11NO/c1-5(3-6)4-7-2/h4H,3,6H2,1-2H3/b5-4-
InChIKeyIQKSTQJKSUJPSA-PLNGDYQASA-N
XLogP0.50
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.15
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

(Z)-1-methoxy-2-methylbut-1-ene
CID 3033475
ethane;(E)-2-methylbut-2-en-1-amine
CID 143126419
(E)-1-methoxyprop-1-en-2-amine
CID 143063375
1-methoxy-2-methylprop-1-ene
CID 551188
ethane;(Z)-1-methoxyprop-1-en-2-amine
CID 143631122
4-methoxy-N,3-dimethylbut-3-enenitrilium
CID 123953721
2-(1,2-dimethoxyethenylsilyl)ethanamine
CID 123537400
1-methoxy-2-methylprop-1-ene;hydrofluoride
CID 174504436
(2E)-2,4-dimethylpenta-2,4-dien-1-amine
CID 126656213
2,4,4-trimethylpent-2-en-1-amine
CID 79330157
2-fluoro-3-(1-methoxyprop-1-en-2-ylamino)oxypropan-1-amine
CID 57205368
ethyl (Z)-4-amino-3-methylbut-2-enoate
CID 87890054

Frequently Asked Questions

What is the IUPAC name of (Z)-3-methoxy-2-methylprop-2-en-1-amine?
The IUPAC name of (Z)-3-methoxy-2-methylprop-2-en-1-amine (CID 171800320) is (Z)-3-methoxy-2-methylprop-2-en-1-amine.
What is the SMILES notation for (Z)-3-methoxy-2-methylprop-2-en-1-amine?
The canonical SMILES for (Z)-3-methoxy-2-methylprop-2-en-1-amine is CO/C=C(/C)CN.
What is the InChIKey of (Z)-3-methoxy-2-methylprop-2-en-1-amine?
The InChIKey is IQKSTQJKSUJPSA-PLNGDYQASA-N. The full InChI is InChI=1S/C5H11NO/c1-5(3-6)4-7-2/h4H,3,6H2,1-2H3/b5-4-.
What are the key properties of (Z)-3-methoxy-2-methylprop-2-en-1-amine?
(Z)-3-methoxy-2-methylprop-2-en-1-amine has a molecular weight of 101.15 g/mol, XLogP of 0.50, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-methoxy-2-methylprop-2-en-1-amine is sourced from PubChem (CID 171800320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).