(2-methylpyrrolidin-3-yl)-(4-propan-2-ylpiperidin-1-yl)methanone

C14H26N2O — CID 102953558

IUPAC(2-methylpyrrolidin-3-yl)-(4-propan-2-ylpiperidin-1-yl)methanone
SMILESCC(C)C1CCN(C(=O)C2CCNC2C)CC1
InChIInChI=1S/C14H26N2O/c1-10(2)12-5-8-16(9-6-12)14(17)13-4-7-15-11(13)3/h10-13,15H,4-9H2,1-3H3
InChIKeySDMVINAQTZJOMM-UHFFFAOYSA-N
MW238.37 g/mol
LogP1.88
Rot. Bonds2

About (2-methylpyrrolidin-3-yl)-(4-propan-2-ylpiperidin-1-yl)methanone

(2-methylpyrrolidin-3-yl)-(4-propan-2-ylpiperidin-1-yl)methanone (PubChem CID 102953558) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is (2-methylpyrrolidin-3-yl)-(4-propan-2-ylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(2-methylpyrrolidin-3-yl)-(4-propan-2-ylpiperidin-1-yl)methanone
PubChem CID102953558
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name(2-methylpyrrolidin-3-yl)-(4-propan-2-ylpiperidin-1-yl)methanone
SMILESCC(C)C1CCN(C(=O)C2CCNC2C)CC1
InChIInChI=1S/C14H26N2O/c1-10(2)12-5-8-16(9-6-12)14(17)13-4-7-15-11(13)3/h10-13,15H,4-9H2,1-3H3
InChIKeySDMVINAQTZJOMM-UHFFFAOYSA-N
XLogP1.88
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2-methylpyrrolidin-3-yl)-(3-methylpyrrolidin-1-yl)methanone
CID 79388150
N-ethyl-4-(2-methylpyrrolidine-3-carbonyl)piperazine-1-carboxamide
CID 79389325
(2-methylpyrrolidin-3-yl)-(1-oxo-1,4-thiazinan-4-yl)methanone
CID 79388557
(3,5-dimethylpiperidin-1-yl)-(2-methylpyrrolidin-3-yl)methanone
CID 79383471
(4-hydroxy-4-methylpiperidin-1-yl)-(2-methylpyrrolidin-3-yl)methanone
CID 81103357
(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-(2-methylpyrrolidin-3-yl)methanone
CID 79384116
[4-(methoxymethyl)piperidin-1-yl]-(2-methylpyrrolidin-3-yl)methanone
CID 79384209
(4-hydroxy-3-methylpiperidin-1-yl)-(2-methylpyrrolidin-3-yl)methanone
CID 114678386
4-ethyl-1-(2-methylpyrrolidine-3-carbonyl)piperidine-4-carboxylic acid
CID 79384911
[(2R,3S)-2-methylpiperidin-3-yl]-piperidin-1-ylmethanone
CID 97050947
(3-ethyl-3-hydroxyazetidin-1-yl)-(2-methylpyrrolidin-3-yl)methanone
CID 107219562
(2-methylpyrrolidin-3-yl)-[4-(morpholin-4-ylmethyl)piperidin-1-yl]methanone
CID 79379397

Frequently Asked Questions

What is the IUPAC name of (2-methylpyrrolidin-3-yl)-(4-propan-2-ylpiperidin-1-yl)methanone?
The IUPAC name of (2-methylpyrrolidin-3-yl)-(4-propan-2-ylpiperidin-1-yl)methanone (CID 102953558) is (2-methylpyrrolidin-3-yl)-(4-propan-2-ylpiperidin-1-yl)methanone.
What is the SMILES notation for (2-methylpyrrolidin-3-yl)-(4-propan-2-ylpiperidin-1-yl)methanone?
The canonical SMILES for (2-methylpyrrolidin-3-yl)-(4-propan-2-ylpiperidin-1-yl)methanone is CC(C)C1CCN(C(=O)C2CCNC2C)CC1.
What is the InChIKey of (2-methylpyrrolidin-3-yl)-(4-propan-2-ylpiperidin-1-yl)methanone?
The InChIKey is SDMVINAQTZJOMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-10(2)12-5-8-16(9-6-12)14(17)13-4-7-15-11(13)3/h10-13,15H,4-9H2,1-3H3.
What are the key properties of (2-methylpyrrolidin-3-yl)-(4-propan-2-ylpiperidin-1-yl)methanone?
(2-methylpyrrolidin-3-yl)-(4-propan-2-ylpiperidin-1-yl)methanone has a molecular weight of 238.37 g/mol, XLogP of 1.88, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylpyrrolidin-3-yl)-(4-propan-2-ylpiperidin-1-yl)methanone is sourced from PubChem (CID 102953558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).