(5R)-3-but-1-en-2-yl-5-methylpiperidine

C10H19N — CID 170450010

IUPAC(5R)-3-but-1-en-2-yl-5-methylpiperidine
SMILESC=C(CC)C1CNC[C@H](C)C1
InChIInChI=1S/C10H19N/c1-4-9(3)10-5-8(2)6-11-7-10/h8,10-11H,3-7H2,1-2H3/t8-,10?/m1/s1
InChIKeyXGZJSZQAMVCLRT-HNHGDDPOSA-N
MW153.27 g/mol
LogP2.20
Rot. Bonds2

About (5R)-3-but-1-en-2-yl-5-methylpiperidine

(5R)-3-but-1-en-2-yl-5-methylpiperidine (PubChem CID 170450010) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is (5R)-3-but-1-en-2-yl-5-methylpiperidine.

Molecular Properties

Compound Name(5R)-3-but-1-en-2-yl-5-methylpiperidine
PubChem CID170450010
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name(5R)-3-but-1-en-2-yl-5-methylpiperidine
SMILESC=C(CC)C1CNC[C@H](C)C1
InChIInChI=1S/C10H19N/c1-4-9(3)10-5-8(2)6-11-7-10/h8,10-11H,3-7H2,1-2H3/t8-,10?/m1/s1
InChIKeyXGZJSZQAMVCLRT-HNHGDDPOSA-N
XLogP2.20
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1-(5-methylpiperidin-3-yl)propan-1-one
CID 130940115
1-[(3S,5R)-5-methylpiperidin-3-yl]ethanone
CID 178194792
azane;3,5-dimethylpiperidine
CID 23174858
1-(5-methylpiperidin-3-yl)prop-2-yn-1-one
CID 130942510
methyl (3R)-5-methylpiperidine-3-carboxylate
CID 178133263
cyclopentyl-(5-methylpiperidin-3-yl)methanone
CID 130804308
methyl 5-methylpiperidine-3-carboxylate;hydrochloride
CID 75464874
4-but-1-en-2-yl-2-methylthiolane
CID 134557509
5-but-1-en-2-yl-2-methylcyclohexan-1-ol
CID 176942654
N-[3-(diethylamino)propyl]-N-ethyl-5-methylpiperidine-3-carboxamide
CID 102993542
[(3S,5R)-5-methylpiperidin-3-yl]methanol;hydrochloride
CID 166104604
[2-(hydroxymethyl)azepan-1-yl]-(5-methylpiperidin-3-yl)methanone
CID 116634917

Frequently Asked Questions

What is the IUPAC name of (5R)-3-but-1-en-2-yl-5-methylpiperidine?
The IUPAC name of (5R)-3-but-1-en-2-yl-5-methylpiperidine (CID 170450010) is (5R)-3-but-1-en-2-yl-5-methylpiperidine.
What is the SMILES notation for (5R)-3-but-1-en-2-yl-5-methylpiperidine?
The canonical SMILES for (5R)-3-but-1-en-2-yl-5-methylpiperidine is C=C(CC)C1CNC[C@H](C)C1.
What is the InChIKey of (5R)-3-but-1-en-2-yl-5-methylpiperidine?
The InChIKey is XGZJSZQAMVCLRT-HNHGDDPOSA-N. The full InChI is InChI=1S/C10H19N/c1-4-9(3)10-5-8(2)6-11-7-10/h8,10-11H,3-7H2,1-2H3/t8-,10?/m1/s1.
What are the key properties of (5R)-3-but-1-en-2-yl-5-methylpiperidine?
(5R)-3-but-1-en-2-yl-5-methylpiperidine has a molecular weight of 153.27 g/mol, XLogP of 2.20, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-3-but-1-en-2-yl-5-methylpiperidine is sourced from PubChem (CID 170450010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).