(4-methylpiperidin-1-yl)-[4-(2-methylpropyl)piperidin-1-yl]methanone

C16H30N2O — CID 167480595

IUPAC(4-methylpiperidin-1-yl)-[4-(2-methylpropyl)piperidin-1-yl]methanone
SMILESCC(C)CC1CCN(C(=O)N2CCC(C)CC2)CC1
InChIInChI=1S/C16H30N2O/c1-13(2)12-15-6-10-18(11-7-15)16(19)17-8-4-14(3)5-9-17/h13-15H,4-12H2,1-3H3
InChIKeyRZTKUEQCESDHHG-UHFFFAOYSA-N
MW266.43 g/mol
LogP3.60
Rot. Bonds2

About (4-methylpiperidin-1-yl)-[4-(2-methylpropyl)piperidin-1-yl]methanone

(4-methylpiperidin-1-yl)-[4-(2-methylpropyl)piperidin-1-yl]methanone (PubChem CID 167480595) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is (4-methylpiperidin-1-yl)-[4-(2-methylpropyl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(4-methylpiperidin-1-yl)-[4-(2-methylpropyl)piperidin-1-yl]methanone
PubChem CID167480595
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name(4-methylpiperidin-1-yl)-[4-(2-methylpropyl)piperidin-1-yl]methanone
SMILESCC(C)CC1CCN(C(=O)N2CCC(C)CC2)CC1
InChIInChI=1S/C16H30N2O/c1-13(2)12-15-6-10-18(11-7-15)16(19)17-8-4-14(3)5-9-17/h13-15H,4-12H2,1-3H3
InChIKeyRZTKUEQCESDHHG-UHFFFAOYSA-N
XLogP3.60
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(4-methylpiperidin-1-yl)-[4-(2-methylpropyl)piperazin-1-yl]methanone
CID 116655615
(4-methylpiperidin-1-yl)-(4-propan-2-ylpiperazin-1-yl)methanone
CID 90447182
2-(dimethylamino)-1-[4-(2-methylpropyl)piperidin-1-yl]ethanone
CID 59001118
(4-hydroxypiperidin-1-yl)-(4-methylpiperidin-1-yl)methanone
CID 58959877
N-[[1-(4-methylpiperidine-1-carbonyl)piperidin-4-yl]methyl]acetamide
CID 102736162
2-amino-3-methyl-1-[4-(2-methylpropyl)piperidin-1-yl]butan-1-one
CID 169182421
1-[4-(2-methylpropyl)piperidin-1-yl]pentan-1-one
CID 171554697
[4-(2-hydroxyethoxy)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone
CID 82691361
bis[4-(1-hydroxyethyl)piperidin-1-yl]methanone
CID 175316755
1-(4-methylpiperidine-1-carbonyl)piperidine-4-carboxamide
CID 115575168
N-chloro-3-(2-methylpropyl)pyrrolidine-1-carboxamide
CID 168862236
[2-(2-hydroxypropyl)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone
CID 79536980

Frequently Asked Questions

What is the IUPAC name of (4-methylpiperidin-1-yl)-[4-(2-methylpropyl)piperidin-1-yl]methanone?
The IUPAC name of (4-methylpiperidin-1-yl)-[4-(2-methylpropyl)piperidin-1-yl]methanone (CID 167480595) is (4-methylpiperidin-1-yl)-[4-(2-methylpropyl)piperidin-1-yl]methanone.
What is the SMILES notation for (4-methylpiperidin-1-yl)-[4-(2-methylpropyl)piperidin-1-yl]methanone?
The canonical SMILES for (4-methylpiperidin-1-yl)-[4-(2-methylpropyl)piperidin-1-yl]methanone is CC(C)CC1CCN(C(=O)N2CCC(C)CC2)CC1.
What is the InChIKey of (4-methylpiperidin-1-yl)-[4-(2-methylpropyl)piperidin-1-yl]methanone?
The InChIKey is RZTKUEQCESDHHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-13(2)12-15-6-10-18(11-7-15)16(19)17-8-4-14(3)5-9-17/h13-15H,4-12H2,1-3H3.
What are the key properties of (4-methylpiperidin-1-yl)-[4-(2-methylpropyl)piperidin-1-yl]methanone?
(4-methylpiperidin-1-yl)-[4-(2-methylpropyl)piperidin-1-yl]methanone has a molecular weight of 266.43 g/mol, XLogP of 3.60, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylpiperidin-1-yl)-[4-(2-methylpropyl)piperidin-1-yl]methanone is sourced from PubChem (CID 167480595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).