N-methyl-1-(1-prop-1-en-2-ylpiperidin-4-yl)piperidin-4-amine

C14H27N3 — CID 178001600

IUPACN-methyl-1-(1-prop-1-en-2-ylpiperidin-4-yl)piperidin-4-amine
SMILESC=C(C)N1CCC(N2CCC(NC)CC2)CC1
InChIInChI=1S/C14H27N3/c1-12(2)16-10-6-14(7-11-16)17-8-4-13(15-3)5-9-17/h13-15H,1,4-11H2,2-3H3
InChIKeyXKINLMCKKRSWFT-UHFFFAOYSA-N
MW237.39 g/mol
LogP1.67
Rot. Bonds3

About N-methyl-1-(1-prop-1-en-2-ylpiperidin-4-yl)piperidin-4-amine

N-methyl-1-(1-prop-1-en-2-ylpiperidin-4-yl)piperidin-4-amine (PubChem CID 178001600) has the molecular formula C14H27N3 and a molecular weight of 237.39 g/mol. Its IUPAC name is N-methyl-1-(1-prop-1-en-2-ylpiperidin-4-yl)piperidin-4-amine.

Molecular Properties

Compound NameN-methyl-1-(1-prop-1-en-2-ylpiperidin-4-yl)piperidin-4-amine
PubChem CID178001600
Molecular FormulaC14H27N3
Molecular Weight237.39 g/mol
Exact Mass237.22
IUPAC NameN-methyl-1-(1-prop-1-en-2-ylpiperidin-4-yl)piperidin-4-amine
SMILESC=C(C)N1CCC(N2CCC(NC)CC2)CC1
InChIInChI=1S/C14H27N3/c1-12(2)16-10-6-14(7-11-16)17-8-4-13(15-3)5-9-17/h13-15H,1,4-11H2,2-3H3
InChIKeyXKINLMCKKRSWFT-UHFFFAOYSA-N
XLogP1.67
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.39
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-piperidin-1-yl-1-prop-1-en-2-ylpiperidine
CID 143020701
1-cyclopropyl-N-methylpiperidin-4-amine;ethane
CID 142484063
1-(1-methoxyethenyl)-N-methylpiperidin-4-amine
CID 142902293
ethane;1-[4-(methylamino)cyclohexyl]piperidin-4-ol
CID 178011364
1-acetyl-N-(1-cyclopropylpiperidin-4-yl)piperidine-4-carboxamide
CID 110750203
3-methyl-1-prop-1-en-2-ylpyrrolidine
CID 90249054
4-chloro-1-prop-1-en-2-ylpiperidine
CID 11367163
1-(3,5-dimethylcyclohexyl)-N-methylpiperidin-4-amine
CID 64737071
1-(3,3-dimethylcyclobutyl)-N-methylpiperidin-4-amine
CID 130865497
2-fluoro-1-[4-(methylamino)piperidin-1-yl]prop-2-en-1-one
CID 168894405
1-[3-(dimethylamino)prop-1-en-2-yl]-N-methylpiperidin-4-amine
CID 171531327
1-N-methyl-4-N-prop-1-en-2-ylcyclohexane-1,4-diamine
CID 89294364

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(1-prop-1-en-2-ylpiperidin-4-yl)piperidin-4-amine?
The IUPAC name of N-methyl-1-(1-prop-1-en-2-ylpiperidin-4-yl)piperidin-4-amine (CID 178001600) is N-methyl-1-(1-prop-1-en-2-ylpiperidin-4-yl)piperidin-4-amine.
What is the SMILES notation for N-methyl-1-(1-prop-1-en-2-ylpiperidin-4-yl)piperidin-4-amine?
The canonical SMILES for N-methyl-1-(1-prop-1-en-2-ylpiperidin-4-yl)piperidin-4-amine is C=C(C)N1CCC(N2CCC(NC)CC2)CC1.
What is the InChIKey of N-methyl-1-(1-prop-1-en-2-ylpiperidin-4-yl)piperidin-4-amine?
The InChIKey is XKINLMCKKRSWFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3/c1-12(2)16-10-6-14(7-11-16)17-8-4-13(15-3)5-9-17/h13-15H,1,4-11H2,2-3H3.
What are the key properties of N-methyl-1-(1-prop-1-en-2-ylpiperidin-4-yl)piperidin-4-amine?
N-methyl-1-(1-prop-1-en-2-ylpiperidin-4-yl)piperidin-4-amine has a molecular weight of 237.39 g/mol, XLogP of 1.67, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(1-prop-1-en-2-ylpiperidin-4-yl)piperidin-4-amine is sourced from PubChem (CID 178001600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).