4-methyl-4-piperidin-1-yl-N-propylhex-1-en-3-amine

C15H30N2 — CID 79064782

IUPAC4-methyl-4-piperidin-1-yl-N-propylhex-1-en-3-amine
SMILESC=CC(NCCC)C(C)(CC)N1CCCCC1
InChIInChI=1S/C15H30N2/c1-5-11-16-14(6-2)15(4,7-3)17-12-9-8-10-13-17/h6,14,16H,2,5,7-13H2,1,3-4H3
InChIKeyHMFKIZDAPQWMSV-UHFFFAOYSA-N
MW238.42 g/mol
LogP3.20
Rot. Bonds7

About 4-methyl-4-piperidin-1-yl-N-propylhex-1-en-3-amine

4-methyl-4-piperidin-1-yl-N-propylhex-1-en-3-amine (PubChem CID 79064782) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 4-methyl-4-piperidin-1-yl-N-propylhex-1-en-3-amine.

Molecular Properties

Compound Name4-methyl-4-piperidin-1-yl-N-propylhex-1-en-3-amine
PubChem CID79064782
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name4-methyl-4-piperidin-1-yl-N-propylhex-1-en-3-amine
SMILESC=CC(NCCC)C(C)(CC)N1CCCCC1
InChIInChI=1S/C15H30N2/c1-5-11-16-14(6-2)15(4,7-3)17-12-9-8-10-13-17/h6,14,16H,2,5,7-13H2,1,3-4H3
InChIKeyHMFKIZDAPQWMSV-UHFFFAOYSA-N
XLogP3.20
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2,2-Diallylpiperazine
CID 686590
2,2-Diallylpiperazine dihydrochloride
CID 2892821
4-Piperidinamine, 4-(2-propen-1-yl)-
CID 12000258
1-[3-(1-Fluoroethenyl)-2-methylhex-5-en-2-yl]piperazine
CID 144144899
1-(5-Fluorohept-1-en-3-yl)piperazine
CID 174315995
1,1,2,2-Tetrakis(prop-2-enyl)piperazin-1-ium
CID 19604703
1,1,2,2-Tetrakis(prop-2-enyl)piperazin-1-ium chloride
CID 20245397
1-Hept-6-en-3-ylpiperazine
CID 22375101
1-Ethyl-2-prop-2-enylpiperazine
CID 22918265
1-Methyl-2-prop-2-enylpiperazine
CID 22918318
1-Methyl-3-prop-2-enylpiperazine
CID 23395683
2,2-Dimethyl-3-(2-methylprop-2-enyl)piperazine
CID 57203546

Frequently Asked Questions

What is the IUPAC name of 4-methyl-4-piperidin-1-yl-N-propylhex-1-en-3-amine?
The IUPAC name of 4-methyl-4-piperidin-1-yl-N-propylhex-1-en-3-amine (CID 79064782) is 4-methyl-4-piperidin-1-yl-N-propylhex-1-en-3-amine.
What is the SMILES notation for 4-methyl-4-piperidin-1-yl-N-propylhex-1-en-3-amine?
The canonical SMILES for 4-methyl-4-piperidin-1-yl-N-propylhex-1-en-3-amine is C=CC(NCCC)C(C)(CC)N1CCCCC1.
What is the InChIKey of 4-methyl-4-piperidin-1-yl-N-propylhex-1-en-3-amine?
The InChIKey is HMFKIZDAPQWMSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-5-11-16-14(6-2)15(4,7-3)17-12-9-8-10-13-17/h6,14,16H,2,5,7-13H2,1,3-4H3.
What are the key properties of 4-methyl-4-piperidin-1-yl-N-propylhex-1-en-3-amine?
4-methyl-4-piperidin-1-yl-N-propylhex-1-en-3-amine has a molecular weight of 238.42 g/mol, XLogP of 3.20, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-4-piperidin-1-yl-N-propylhex-1-en-3-amine is sourced from PubChem (CID 79064782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).