1-[4-[(1-propan-2-ylpiperidin-4-yl)amino]piperidin-1-yl]ethanone

C15H29N3O — CID 43223565

IUPAC1-[4-[(1-propan-2-ylpiperidin-4-yl)amino]piperidin-1-yl]ethanone
SMILESCC(=O)N1CCC(NC2CCN(C(C)C)CC2)CC1
InChIInChI=1S/C15H29N3O/c1-12(2)17-8-4-14(5-9-17)16-15-6-10-18(11-7-15)13(3)19/h12,14-16H,4-11H2,1-3H3
InChIKeyVDDCVCAZDLMWPU-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.46
Rot. Bonds3

About 1-[4-[(1-propan-2-ylpiperidin-4-yl)amino]piperidin-1-yl]ethanone

1-[4-[(1-propan-2-ylpiperidin-4-yl)amino]piperidin-1-yl]ethanone (PubChem CID 43223565) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 1-[4-[(1-propan-2-ylpiperidin-4-yl)amino]piperidin-1-yl]ethanone.

Molecular Properties

Compound Name1-[4-[(1-propan-2-ylpiperidin-4-yl)amino]piperidin-1-yl]ethanone
PubChem CID43223565
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name1-[4-[(1-propan-2-ylpiperidin-4-yl)amino]piperidin-1-yl]ethanone
SMILESCC(=O)N1CCC(NC2CCN(C(C)C)CC2)CC1
InChIInChI=1S/C15H29N3O/c1-12(2)17-8-4-14(5-9-17)16-15-6-10-18(11-7-15)13(3)19/h12,14-16H,4-11H2,1-3H3
InChIKeyVDDCVCAZDLMWPU-UHFFFAOYSA-N
XLogP1.46
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-(cyclopentylamino)piperidin-1-yl]ethanone
CID 43222863
1-[4-(4-propan-2-ylpiperazin-1-yl)piperidin-1-yl]ethanone
CID 156836562
N-methyl-2-[(1-propan-2-ylpiperidin-4-yl)amino]propanamide
CID 60677160
2-[4-[(1-propan-2-ylpiperidin-4-yl)amino]piperidin-1-yl]acetamide
CID 43746779
2-methyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide;molecular hydrogen
CID 176982787
1-[4-(3-methylbutan-2-ylamino)piperidin-1-yl]ethanone
CID 43223288
1-propan-2-yl-N-(thietan-3-yl)piperidin-4-amine
CID 126987499
4-propan-2-yl-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide
CID 162725913
1-ethyl-N-(1-propan-2-ylpiperidin-4-yl)piperidin-4-amine
CID 28716489
2-bromo-3-methyl-N-(1-propan-2-ylpiperidin-4-yl)butanamide
CID 43700528
ethane;1-(1-propan-2-ylpiperidin-4-yl)ethanone
CID 177135939
N-(1-acetylpiperidin-4-yl)-2-(methylamino)propanamide
CID 62639484

Frequently Asked Questions

What is the IUPAC name of 1-[4-[(1-propan-2-ylpiperidin-4-yl)amino]piperidin-1-yl]ethanone?
The IUPAC name of 1-[4-[(1-propan-2-ylpiperidin-4-yl)amino]piperidin-1-yl]ethanone (CID 43223565) is 1-[4-[(1-propan-2-ylpiperidin-4-yl)amino]piperidin-1-yl]ethanone.
What is the SMILES notation for 1-[4-[(1-propan-2-ylpiperidin-4-yl)amino]piperidin-1-yl]ethanone?
The canonical SMILES for 1-[4-[(1-propan-2-ylpiperidin-4-yl)amino]piperidin-1-yl]ethanone is CC(=O)N1CCC(NC2CCN(C(C)C)CC2)CC1.
What is the InChIKey of 1-[4-[(1-propan-2-ylpiperidin-4-yl)amino]piperidin-1-yl]ethanone?
The InChIKey is VDDCVCAZDLMWPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-12(2)17-8-4-14(5-9-17)16-15-6-10-18(11-7-15)13(3)19/h12,14-16H,4-11H2,1-3H3.
What are the key properties of 1-[4-[(1-propan-2-ylpiperidin-4-yl)amino]piperidin-1-yl]ethanone?
1-[4-[(1-propan-2-ylpiperidin-4-yl)amino]piperidin-1-yl]ethanone has a molecular weight of 267.42 g/mol, XLogP of 1.46, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[(1-propan-2-ylpiperidin-4-yl)amino]piperidin-1-yl]ethanone is sourced from PubChem (CID 43223565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).