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

3-methyl-3-piperidin-1-yl-N-propylnon-8-en-4-amine
CID 79065087
3-methyl-N-propyl-3-pyrrolidin-1-ylheptan-4-amine
CID 79069357
1-methoxy-5-methyl-5-piperidin-1-yl-N-propylheptan-4-amine
CID 114856241
2-methyl-1-(4-methylcyclohexyl)-N-propyl-2-pyrrolidin-1-ylbutan-1-amine
CID 79059842
2-methyl-1-(5-methylthiophen-3-yl)-N-propyl-2-pyrrolidin-1-ylbutan-1-amine
CID 79069595
1-(4-chlorophenyl)-2-methyl-N-propyl-2-pyrrolidin-1-ylbutan-1-amine
CID 79059844
N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine
CID 79069202
N-ethyl-2,4-dimethyl-4-piperidin-1-ylhex-1-en-3-amine
CID 79179721
N-ethyl-3,7,7-trimethyl-3-piperidin-1-yloctan-4-amine
CID 79064855
N,4-dimethyl-4-piperidin-1-ylhexan-3-amine
CID 79065370
3-(azepan-1-yl)-1-cyclopropyl-3-methyl-N-propylbutan-2-amine
CID 79051842
3-ethyl-N-propyl-3-pyrrolidin-1-ylnon-8-en-4-amine
CID 79068007

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).