(2R)-4-methoxy-2-methylpent-4-en-1-amine

C7H15NO — CID 163577748

IUPAC(2R)-4-methoxy-2-methylpent-4-en-1-amine
SMILESC=C(C[C@@H](C)CN)OC
InChIInChI=1S/C7H15NO/c1-6(5-8)4-7(2)9-3/h6H,2,4-5,8H2,1,3H3/t6-/m1/s1
InChIKeyGEYPIYYVVPMELC-ZCFIWIBFSA-N
MW129.20 g/mol
LogP1.13
Rot. Bonds4

About (2R)-4-methoxy-2-methylpent-4-en-1-amine

(2R)-4-methoxy-2-methylpent-4-en-1-amine (PubChem CID 163577748) has the molecular formula C7H15NO and a molecular weight of 129.20 g/mol. Its IUPAC name is (2R)-4-methoxy-2-methylpent-4-en-1-amine.

Molecular Properties

Compound Name(2R)-4-methoxy-2-methylpent-4-en-1-amine
PubChem CID163577748
Molecular FormulaC7H15NO
Molecular Weight129.20 g/mol
Exact Mass129.12
IUPAC Name(2R)-4-methoxy-2-methylpent-4-en-1-amine
SMILESC=C(C[C@@H](C)CN)OC
InChIInChI=1S/C7H15NO/c1-6(5-8)4-7(2)9-3/h6H,2,4-5,8H2,1,3H3/t6-/m1/s1
InChIKeyGEYPIYYVVPMELC-ZCFIWIBFSA-N
XLogP1.13
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.20
LogP ≤ 51.13
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

methoxycarbonyl (3S)-4-amino-3-methylbutanoate
CID 174679266
5-amino-1-methoxy-4-methylpentan-2-one
CID 116596528
(3R)-4-amino-3-methylbutanoic acid;hydrochloride
CID 87721123
4-amino-3-methylbutanoic acid;2-methylpropane
CID 143811203
methyl 3-[(4-amino-3-methylbutanoyl)amino]propanoate
CID 81087612
methyl 2-[(4-amino-3-methylbutanoyl)amino]-4-methylpentanoate
CID 81076154
4-amino-N-tert-butyl-3-methylbutanamide
CID 81071972
4-amino-N-[(2S)-2-hydroxypropyl]-3-methylbutanamide
CID 107221231
methyl 5-iodo-3-methylpentanoate
CID 19767765
methyl 3-methylhept-6-enoate
CID 19865945
methyl (6S)-7-amino-6-methylheptanoate
CID 163456420
(4E)-2,4,5-trimethyl-6-methylideneocta-4,7-dien-1-amine
CID 165405410

Frequently Asked Questions

What is the IUPAC name of (2R)-4-methoxy-2-methylpent-4-en-1-amine?
The IUPAC name of (2R)-4-methoxy-2-methylpent-4-en-1-amine (CID 163577748) is (2R)-4-methoxy-2-methylpent-4-en-1-amine.
What is the SMILES notation for (2R)-4-methoxy-2-methylpent-4-en-1-amine?
The canonical SMILES for (2R)-4-methoxy-2-methylpent-4-en-1-amine is C=C(C[C@@H](C)CN)OC.
What is the InChIKey of (2R)-4-methoxy-2-methylpent-4-en-1-amine?
The InChIKey is GEYPIYYVVPMELC-ZCFIWIBFSA-N. The full InChI is InChI=1S/C7H15NO/c1-6(5-8)4-7(2)9-3/h6H,2,4-5,8H2,1,3H3/t6-/m1/s1.
What are the key properties of (2R)-4-methoxy-2-methylpent-4-en-1-amine?
(2R)-4-methoxy-2-methylpent-4-en-1-amine has a molecular weight of 129.20 g/mol, XLogP of 1.13, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-methoxy-2-methylpent-4-en-1-amine is sourced from PubChem (CID 163577748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).