1-(3-chloro-2-methylprop-2-enyl)-2-methylpiperidin-4-amine

C10H19ClN2 — CID 106439515

IUPAC1-(3-chloro-2-methylprop-2-enyl)-2-methylpiperidin-4-amine
SMILESCC(=CCl)CN1CCC(N)CC1C
InChIInChI=1S/C10H19ClN2/c1-8(6-11)7-13-4-3-10(12)5-9(13)2/h6,9-10H,3-5,7,12H2,1-2H3
InChIKeyNLTXUQSGVBPLME-UHFFFAOYSA-N
MW202.73 g/mol
LogP1.94
Rot. Bonds2

About 1-(3-chloro-2-methylprop-2-enyl)-2-methylpiperidin-4-amine

1-(3-chloro-2-methylprop-2-enyl)-2-methylpiperidin-4-amine (PubChem CID 106439515) has the molecular formula C10H19ClN2 and a molecular weight of 202.73 g/mol. Its IUPAC name is 1-(3-chloro-2-methylprop-2-enyl)-2-methylpiperidin-4-amine.

Molecular Properties

Compound Name1-(3-chloro-2-methylprop-2-enyl)-2-methylpiperidin-4-amine
PubChem CID106439515
Molecular FormulaC10H19ClN2
Molecular Weight202.73 g/mol
Exact Mass202.12
IUPAC Name1-(3-chloro-2-methylprop-2-enyl)-2-methylpiperidin-4-amine
SMILESCC(=CCl)CN1CCC(N)CC1C
InChIInChI=1S/C10H19ClN2/c1-8(6-11)7-13-4-3-10(12)5-9(13)2/h6,9-10H,3-5,7,12H2,1-2H3
InChIKeyNLTXUQSGVBPLME-UHFFFAOYSA-N
XLogP1.94
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.73
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-bromoprop-2-enyl)-2-methylpiperidin-4-amine
CID 115313002
propan-2-yl 2-(4-amino-2-methylpiperidin-1-yl)acetate
CID 115313197
2-(4-amino-2-methylpiperidin-1-yl)-N-prop-2-ynylacetamide
CID 115313218
2-(4-amino-2-methylpiperidin-1-yl)acetonitrile
CID 115313042
1-(4-amino-2-methylpiperidin-1-yl)-3-cyclopentylpropan-2-ol
CID 103160911
(3R)-1-(3-chloro-2-methylprop-2-enyl)piperidin-3-amine
CID 106439538
2-(4-amino-2-methylpiperidin-1-yl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide
CID 115313084
4-[(4-amino-2-methylpiperidin-1-yl)methyl]benzoic acid
CID 115312935
2-(4-amino-2-methylpiperidin-1-yl)-N-(cyclohexen-1-yl)-N-cyclopropylacetamide
CID 115313060
1-[2-(cyclopropylmethoxy)ethyl]-2-methylpiperidin-4-amine
CID 103821324
4-chloro-1-(3-chloro-2-methylprop-2-enyl)piperidine
CID 106439936
methyl 4-(4-amino-2-methylpiperidin-1-yl)butanoate
CID 115313229

Frequently Asked Questions

What is the IUPAC name of 1-(3-chloro-2-methylprop-2-enyl)-2-methylpiperidin-4-amine?
The IUPAC name of 1-(3-chloro-2-methylprop-2-enyl)-2-methylpiperidin-4-amine (CID 106439515) is 1-(3-chloro-2-methylprop-2-enyl)-2-methylpiperidin-4-amine.
What is the SMILES notation for 1-(3-chloro-2-methylprop-2-enyl)-2-methylpiperidin-4-amine?
The canonical SMILES for 1-(3-chloro-2-methylprop-2-enyl)-2-methylpiperidin-4-amine is CC(=CCl)CN1CCC(N)CC1C.
What is the InChIKey of 1-(3-chloro-2-methylprop-2-enyl)-2-methylpiperidin-4-amine?
The InChIKey is NLTXUQSGVBPLME-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19ClN2/c1-8(6-11)7-13-4-3-10(12)5-9(13)2/h6,9-10H,3-5,7,12H2,1-2H3.
What are the key properties of 1-(3-chloro-2-methylprop-2-enyl)-2-methylpiperidin-4-amine?
1-(3-chloro-2-methylprop-2-enyl)-2-methylpiperidin-4-amine has a molecular weight of 202.73 g/mol, XLogP of 1.94, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chloro-2-methylprop-2-enyl)-2-methylpiperidin-4-amine is sourced from PubChem (CID 106439515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).