(Z)-N-(1-methoxyethyl)-2-methylhex-3-en-2-amine

C10H21NO — CID 163907496

IUPAC(Z)-N-(1-methoxyethyl)-2-methylhex-3-en-2-amine
SMILESCC/C=C\C(C)(C)NC(C)OC
InChIInChI=1S/C10H21NO/c1-6-7-8-10(3,4)11-9(2)12-5/h7-9,11H,6H2,1-5H3/b8-7-
InChIKeyQPFWUVGWQDMAJN-FPLPWBNLSA-N
MW171.28 g/mol
LogP2.31
Rot. Bonds5

About (Z)-N-(1-methoxyethyl)-2-methylhex-3-en-2-amine

(Z)-N-(1-methoxyethyl)-2-methylhex-3-en-2-amine (PubChem CID 163907496) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is (Z)-N-(1-methoxyethyl)-2-methylhex-3-en-2-amine.

Molecular Properties

Compound Name(Z)-N-(1-methoxyethyl)-2-methylhex-3-en-2-amine
PubChem CID163907496
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name(Z)-N-(1-methoxyethyl)-2-methylhex-3-en-2-amine
SMILESCC/C=C\C(C)(C)NC(C)OC
InChIInChI=1S/C10H21NO/c1-6-7-8-10(3,4)11-9(2)12-5/h7-9,11H,6H2,1-5H3/b8-7-
InChIKeyQPFWUVGWQDMAJN-FPLPWBNLSA-N
XLogP2.31
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(Z)-5-ethoxy-N-methylpent-2-en-1-amine
CID 89469234
N-(1-methoxyethyl)-1,4-dimethylcyclohepta-2,4,6-trien-1-amine
CID 91122924
(E)-N-tert-butyl-4,4-dimethylpent-2-en-1-amine;N-ethoxymethanamine
CID 159855754
(Z)-N-(1,2-dimethoxyethyl)-2-methylpent-3-en-2-amine
CID 163562568
(1E,4Z,6Z,8Z)-N-(1-methoxyethyl)cycloundeca-1,4,6,8,10-pentaen-1-amine
CID 164071498
5-(But-2-enylamino)-5-methylhepta-3,6-dienal
CID 174341688
5-Methoxypent-2-enyl-di(propan-2-yl)azanium
CID 4083277
N-(2-methoxyethyl)-4,4-dimethylpent-2-en-1-amine
CID 79341184
N-(2-methoxyethyl)-4-methylpent-2-en-1-amine
CID 79346772
N-tert-butyl-5-methoxypent-3-en-1-amine
CID 79598249
(E)-6-methoxy-N,5-dimethylhex-3-en-2-amine
CID 103092180
(E)-N-ethyl-6-methoxy-5-methylhex-3-en-2-amine
CID 103092485

Frequently Asked Questions

What is the IUPAC name of (Z)-N-(1-methoxyethyl)-2-methylhex-3-en-2-amine?
The IUPAC name of (Z)-N-(1-methoxyethyl)-2-methylhex-3-en-2-amine (CID 163907496) is (Z)-N-(1-methoxyethyl)-2-methylhex-3-en-2-amine.
What is the SMILES notation for (Z)-N-(1-methoxyethyl)-2-methylhex-3-en-2-amine?
The canonical SMILES for (Z)-N-(1-methoxyethyl)-2-methylhex-3-en-2-amine is CC/C=C\C(C)(C)NC(C)OC.
What is the InChIKey of (Z)-N-(1-methoxyethyl)-2-methylhex-3-en-2-amine?
The InChIKey is QPFWUVGWQDMAJN-FPLPWBNLSA-N. The full InChI is InChI=1S/C10H21NO/c1-6-7-8-10(3,4)11-9(2)12-5/h7-9,11H,6H2,1-5H3/b8-7-.
What are the key properties of (Z)-N-(1-methoxyethyl)-2-methylhex-3-en-2-amine?
(Z)-N-(1-methoxyethyl)-2-methylhex-3-en-2-amine has a molecular weight of 171.28 g/mol, XLogP of 2.31, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-(1-methoxyethyl)-2-methylhex-3-en-2-amine is sourced from PubChem (CID 163907496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).