(Z)-4-methyl-5-(5-methyloxolan-2-yl)-N-(2-methylpropyl)pent-3-en-1-amine

C15H29NO — CID 103132390

IUPAC(Z)-4-methyl-5-(5-methyloxolan-2-yl)-N-(2-methylpropyl)pent-3-en-1-amine
SMILESC/C(=C/CCNCC(C)C)CC1CCC(C)O1
InChIInChI=1S/C15H29NO/c1-12(2)11-16-9-5-6-13(3)10-15-8-7-14(4)17-15/h6,12,14-16H,5,7-11H2,1-4H3/b13-6-
InChIKeyFMMKKNNJJVNBPZ-MLPAPPSSSA-N
MW239.40 g/mol
LogP3.53
Rot. Bonds7

About (Z)-4-methyl-5-(5-methyloxolan-2-yl)-N-(2-methylpropyl)pent-3-en-1-amine

(Z)-4-methyl-5-(5-methyloxolan-2-yl)-N-(2-methylpropyl)pent-3-en-1-amine (PubChem CID 103132390) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is (Z)-4-methyl-5-(5-methyloxolan-2-yl)-N-(2-methylpropyl)pent-3-en-1-amine.

Molecular Properties

Compound Name(Z)-4-methyl-5-(5-methyloxolan-2-yl)-N-(2-methylpropyl)pent-3-en-1-amine
PubChem CID103132390
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC Name(Z)-4-methyl-5-(5-methyloxolan-2-yl)-N-(2-methylpropyl)pent-3-en-1-amine
SMILESC/C(=C/CCNCC(C)C)CC1CCC(C)O1
InChIInChI=1S/C15H29NO/c1-12(2)11-16-9-5-6-13(3)10-15-8-7-14(4)17-15/h6,12,14-16H,5,7-11H2,1-4H3/b13-6-
InChIKeyFMMKKNNJJVNBPZ-MLPAPPSSSA-N
XLogP3.53
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-tert-butyl-4-methyl-5-(5-methyloxolan-2-yl)pent-3-en-1-amine
CID 103132387
5-(2-bicyclo[2.2.1]heptanyl)-4-methyl-N-(2-methylpropyl)pent-3-en-1-amine
CID 79606979
4-methyl-N-(2-methylpropyl)-5-propan-2-yloxypent-3-en-1-amine
CID 79607218
6-ethyl-4-methyl-N-(2-methylpropyl)oct-3-en-1-amine
CID 82935709
N-(2-methylpropyl)-4-(oxolan-3-yl)pent-3-en-1-amine
CID 79606970
4-methyl-N-(2-methylpropyl)oct-3-en-7-yn-1-amine
CID 79607908
1-[(2S,5R)-5-methyloxolan-2-yl]propan-2-one
CID 45085675
N-(2-methoxyethyl)-3-methyl-2-[(5-methyloxolan-2-yl)methyl]butan-1-amine
CID 103138623
4-methyl-5-(oxan-4-yl)-N-propan-2-ylpent-3-en-1-amine
CID 79599390
N-[(5-methyloxolan-3-yl)methyl]-N'-(2-methylpropyl)ethane-1,2-diamine
CID 114825454
5-(4-ethylphenyl)-4-methyl-N-(2-methylpropyl)pent-3-en-1-amine
CID 79607637
4-methyl-5-(oxolan-2-yl)-N-propylpent-3-en-1-amine
CID 79598732

Frequently Asked Questions

What is the IUPAC name of (Z)-4-methyl-5-(5-methyloxolan-2-yl)-N-(2-methylpropyl)pent-3-en-1-amine?
The IUPAC name of (Z)-4-methyl-5-(5-methyloxolan-2-yl)-N-(2-methylpropyl)pent-3-en-1-amine (CID 103132390) is (Z)-4-methyl-5-(5-methyloxolan-2-yl)-N-(2-methylpropyl)pent-3-en-1-amine.
What is the SMILES notation for (Z)-4-methyl-5-(5-methyloxolan-2-yl)-N-(2-methylpropyl)pent-3-en-1-amine?
The canonical SMILES for (Z)-4-methyl-5-(5-methyloxolan-2-yl)-N-(2-methylpropyl)pent-3-en-1-amine is C/C(=C/CCNCC(C)C)CC1CCC(C)O1.
What is the InChIKey of (Z)-4-methyl-5-(5-methyloxolan-2-yl)-N-(2-methylpropyl)pent-3-en-1-amine?
The InChIKey is FMMKKNNJJVNBPZ-MLPAPPSSSA-N. The full InChI is InChI=1S/C15H29NO/c1-12(2)11-16-9-5-6-13(3)10-15-8-7-14(4)17-15/h6,12,14-16H,5,7-11H2,1-4H3/b13-6-.
What are the key properties of (Z)-4-methyl-5-(5-methyloxolan-2-yl)-N-(2-methylpropyl)pent-3-en-1-amine?
(Z)-4-methyl-5-(5-methyloxolan-2-yl)-N-(2-methylpropyl)pent-3-en-1-amine has a molecular weight of 239.40 g/mol, XLogP of 3.53, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-methyl-5-(5-methyloxolan-2-yl)-N-(2-methylpropyl)pent-3-en-1-amine is sourced from PubChem (CID 103132390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).