1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpiperidin-4-amine

C11H23N3 — CID 171531327

IUPAC1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpiperidin-4-amine
SMILESC=C(CN(C)C)N1CCC(NC)CC1
InChIInChI=1S/C11H23N3/c1-10(9-13(3)4)14-7-5-11(12-2)6-8-14/h11-12H,1,5-9H2,2-4H3
InChIKeyCXVVYKRMHRDWMF-UHFFFAOYSA-N
MW197.33 g/mol
LogP0.75
Rot. Bonds4

About 1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpiperidin-4-amine

1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpiperidin-4-amine (PubChem CID 171531327) has the molecular formula C11H23N3 and a molecular weight of 197.33 g/mol. Its IUPAC name is 1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpiperidin-4-amine.

Molecular Properties

Compound Name1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpiperidin-4-amine
PubChem CID171531327
Molecular FormulaC11H23N3
Molecular Weight197.33 g/mol
Exact Mass197.19
IUPAC Name1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpiperidin-4-amine
SMILESC=C(CN(C)C)N1CCC(NC)CC1
InChIInChI=1S/C11H23N3/c1-10(9-13(3)4)14-7-5-11(12-2)6-8-14/h11-12H,1,5-9H2,2-4H3
InChIKeyCXVVYKRMHRDWMF-UHFFFAOYSA-N
XLogP0.75
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.33
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dimethyl-2-(4-methylpiperazin-1-yl)prop-2-en-1-amine
CID 159231487
1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpyrrolidin-2-amine
CID 171531791
1-(1-methoxyethenyl)-N-methylpiperidin-4-amine
CID 142902293
2-fluoro-1-[4-(methylamino)piperidin-1-yl]prop-2-en-1-one
CID 168894405
N-methyl-1-(1-prop-1-en-2-ylpiperidin-4-yl)piperidin-4-amine
CID 178001600
4-(methylamino)piperidine-1-carboxamide
CID 43754889
2-(dimethylamino)-3-methyl-1-[4-(methylamino)piperidin-1-yl]butan-1-one;dihydrochloride
CID 119561287
N-methyl-1-(2-methylprop-2-enyl)pyrrolidin-3-amine
CID 115300548
cyclopropyl-[4-(methylamino)piperidin-1-yl]methanone
CID 60817866
3-hydroxy-1-[4-(methylamino)piperidin-1-yl]butan-1-one
CID 54408346
3,3,3-trifluoro-1-[4-(methylamino)piperidin-1-yl]propan-1-one
CID 60818049
[4-(methylamino)piperidin-1-yl]-[4-[methyl(propyl)amino]phenyl]methanone;dihydrochloride
CID 119564141

Frequently Asked Questions

What is the IUPAC name of 1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpiperidin-4-amine?
The IUPAC name of 1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpiperidin-4-amine (CID 171531327) is 1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpiperidin-4-amine.
What is the SMILES notation for 1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpiperidin-4-amine?
The canonical SMILES for 1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpiperidin-4-amine is C=C(CN(C)C)N1CCC(NC)CC1.
What is the InChIKey of 1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpiperidin-4-amine?
The InChIKey is CXVVYKRMHRDWMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3/c1-10(9-13(3)4)14-7-5-11(12-2)6-8-14/h11-12H,1,5-9H2,2-4H3.
What are the key properties of 1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpiperidin-4-amine?
1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpiperidin-4-amine has a molecular weight of 197.33 g/mol, XLogP of 0.75, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpiperidin-4-amine is sourced from PubChem (CID 171531327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).