2,3-dichloro-N-methyl-N-(piperidin-2-ylmethyl)prop-2-en-1-amine

C10H18Cl2N2 — CID 106635513

IUPAC2,3-dichloro-N-methyl-N-(piperidin-2-ylmethyl)prop-2-en-1-amine
SMILESCN(CC(Cl)=CCl)CC1CCCCN1
InChIInChI=1S/C10H18Cl2N2/c1-14(7-9(12)6-11)8-10-4-2-3-5-13-10/h6,10,13H,2-5,7-8H2,1H3
InChIKeyRGGYQZVYTYEHCF-UHFFFAOYSA-N
MW237.17 g/mol
LogP2.38
Rot. Bonds4

About 2,3-dichloro-N-methyl-N-(piperidin-2-ylmethyl)prop-2-en-1-amine

2,3-dichloro-N-methyl-N-(piperidin-2-ylmethyl)prop-2-en-1-amine (PubChem CID 106635513) has the molecular formula C10H18Cl2N2 and a molecular weight of 237.17 g/mol. Its IUPAC name is 2,3-dichloro-N-methyl-N-(piperidin-2-ylmethyl)prop-2-en-1-amine.

Molecular Properties

Compound Name2,3-dichloro-N-methyl-N-(piperidin-2-ylmethyl)prop-2-en-1-amine
PubChem CID106635513
Molecular FormulaC10H18Cl2N2
Molecular Weight237.17 g/mol
Exact Mass236.08
IUPAC Name2,3-dichloro-N-methyl-N-(piperidin-2-ylmethyl)prop-2-en-1-amine
SMILESCN(CC(Cl)=CCl)CC1CCCCN1
InChIInChI=1S/C10H18Cl2N2/c1-14(7-9(12)6-11)8-10-4-2-3-5-13-10/h6,10,13H,2-5,7-8H2,1H3
InChIKeyRGGYQZVYTYEHCF-UHFFFAOYSA-N
XLogP2.38
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.17
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-dichloro-N-methyl-N-(piperidin-4-ylmethyl)prop-2-en-1-amine
CID 79717089
N,N-dimethyl-1-piperidin-2-ylmethanamine;dihydrochloride
CID 45075192
3-[methyl(piperidin-2-ylmethyl)amino]propanoic acid
CID 106635493
4-[methyl(piperidin-2-ylmethyl)amino]butan-1-ol
CID 106635214
1-cyclopentyl-N-methyl-N-(pyrrolidin-2-ylmethyl)methanamine
CID 63631590
2-[methyl(piperidin-2-ylmethyl)amino]-N-pyrimidin-2-ylacetamide
CID 106635732
1-(2-methylpiperidin-1-yl)-2-[methyl(piperidin-2-ylmethyl)amino]ethanone
CID 106635178
N-(azepan-2-ylmethyl)-2,2,2-trifluoro-N-methylethanamine
CID 64570764
3-[[methyl(pyrrolidin-2-ylmethyl)amino]methyl]cyclobutan-1-ol
CID 106639630
N-(3-iodophenyl)-2-[methyl(piperidin-2-ylmethyl)amino]acetamide
CID 106635710
N-ethyl-N-methyl-2-[methyl(pyrrolidin-2-ylmethyl)amino]acetamide
CID 106614264
N-[(5-chlorothiophen-2-yl)methyl]-N-methyl-2-[methyl(piperidin-2-ylmethyl)amino]acetamide
CID 106635709

Frequently Asked Questions

What is the IUPAC name of 2,3-dichloro-N-methyl-N-(piperidin-2-ylmethyl)prop-2-en-1-amine?
The IUPAC name of 2,3-dichloro-N-methyl-N-(piperidin-2-ylmethyl)prop-2-en-1-amine (CID 106635513) is 2,3-dichloro-N-methyl-N-(piperidin-2-ylmethyl)prop-2-en-1-amine.
What is the SMILES notation for 2,3-dichloro-N-methyl-N-(piperidin-2-ylmethyl)prop-2-en-1-amine?
The canonical SMILES for 2,3-dichloro-N-methyl-N-(piperidin-2-ylmethyl)prop-2-en-1-amine is CN(CC(Cl)=CCl)CC1CCCCN1.
What is the InChIKey of 2,3-dichloro-N-methyl-N-(piperidin-2-ylmethyl)prop-2-en-1-amine?
The InChIKey is RGGYQZVYTYEHCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18Cl2N2/c1-14(7-9(12)6-11)8-10-4-2-3-5-13-10/h6,10,13H,2-5,7-8H2,1H3.
What are the key properties of 2,3-dichloro-N-methyl-N-(piperidin-2-ylmethyl)prop-2-en-1-amine?
2,3-dichloro-N-methyl-N-(piperidin-2-ylmethyl)prop-2-en-1-amine has a molecular weight of 237.17 g/mol, XLogP of 2.38, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dichloro-N-methyl-N-(piperidin-2-ylmethyl)prop-2-en-1-amine is sourced from PubChem (CID 106635513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).