(4-methylpiperidin-4-yl)-(4-propan-2-ylpiperidin-1-yl)methanone

C15H28N2O — CID 103840374

IUPAC(4-methylpiperidin-4-yl)-(4-propan-2-ylpiperidin-1-yl)methanone
SMILESCC(C)C1CCN(C(=O)C2(C)CCNCC2)CC1
InChIInChI=1S/C15H28N2O/c1-12(2)13-4-10-17(11-5-13)14(18)15(3)6-8-16-9-7-15/h12-13,16H,4-11H2,1-3H3
InChIKeyDRJWRANNFYCDDX-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.27
Rot. Bonds2

About (4-methylpiperidin-4-yl)-(4-propan-2-ylpiperidin-1-yl)methanone

(4-methylpiperidin-4-yl)-(4-propan-2-ylpiperidin-1-yl)methanone (PubChem CID 103840374) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is (4-methylpiperidin-4-yl)-(4-propan-2-ylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(4-methylpiperidin-4-yl)-(4-propan-2-ylpiperidin-1-yl)methanone
PubChem CID103840374
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC Name(4-methylpiperidin-4-yl)-(4-propan-2-ylpiperidin-1-yl)methanone
SMILESCC(C)C1CCN(C(=O)C2(C)CCNCC2)CC1
InChIInChI=1S/C15H28N2O/c1-12(2)13-4-10-17(11-5-13)14(18)15(3)6-8-16-9-7-15/h12-13,16H,4-11H2,1-3H3
InChIKeyDRJWRANNFYCDDX-UHFFFAOYSA-N
XLogP2.27
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-Diethyl-4-piperidinecarboxamide
CID 410920
N,N-dimethylpiperidine-4-carboxamide
CID 411689
N-[3-(dimethylamino)propyl]piperidine-4-carboxamide
CID 2186960
1-acetyl-N-(1-propylpiperidin-4-yl)piperidine-4-carboxamide
CID 6467229
1-(Piperidin-4-ylcarbonyl)piperidine
CID 2794688
N-((1-methylpiperidin-4-yl)methyl)pivalamide
CID 16895339
1-(3,9-Diazaspiro[5.5]undecan-3-yl)ethan-1-one
CID 57448395
1-Methyl-4-(piperidine-4-carbonyl)piperazine
CID 2760037
4-Tert-butylpiperidin-2-one
CID 14146873
4-(Piperidine-1-carbonyl)piperidine hydrochloride
CID 17385515
1-(4-Methylpiperazin-1-yl)-2-(piperidin-4-yl)ethan-1-one
CID 24702180
1-(4-Ethylpiperazin-1-yl)-2-(piperidin-4-yl)ethan-1-one
CID 24703734

Frequently Asked Questions

What is the IUPAC name of (4-methylpiperidin-4-yl)-(4-propan-2-ylpiperidin-1-yl)methanone?
The IUPAC name of (4-methylpiperidin-4-yl)-(4-propan-2-ylpiperidin-1-yl)methanone (CID 103840374) is (4-methylpiperidin-4-yl)-(4-propan-2-ylpiperidin-1-yl)methanone.
What is the SMILES notation for (4-methylpiperidin-4-yl)-(4-propan-2-ylpiperidin-1-yl)methanone?
The canonical SMILES for (4-methylpiperidin-4-yl)-(4-propan-2-ylpiperidin-1-yl)methanone is CC(C)C1CCN(C(=O)C2(C)CCNCC2)CC1.
What is the InChIKey of (4-methylpiperidin-4-yl)-(4-propan-2-ylpiperidin-1-yl)methanone?
The InChIKey is DRJWRANNFYCDDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-12(2)13-4-10-17(11-5-13)14(18)15(3)6-8-16-9-7-15/h12-13,16H,4-11H2,1-3H3.
What are the key properties of (4-methylpiperidin-4-yl)-(4-propan-2-ylpiperidin-1-yl)methanone?
(4-methylpiperidin-4-yl)-(4-propan-2-ylpiperidin-1-yl)methanone has a molecular weight of 252.40 g/mol, XLogP of 2.27, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylpiperidin-4-yl)-(4-propan-2-ylpiperidin-1-yl)methanone is sourced from PubChem (CID 103840374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).