2-(1-piperidin-2-ylpropan-2-ylamino)-1-pyrrolidin-1-ylethanone

C14H27N3O — CID 113405923

IUPAC2-(1-piperidin-2-ylpropan-2-ylamino)-1-pyrrolidin-1-ylethanone
SMILESCC(CC1CCCCN1)NCC(=O)N1CCCC1
InChIInChI=1S/C14H27N3O/c1-12(10-13-6-2-3-7-15-13)16-11-14(18)17-8-4-5-9-17/h12-13,15-16H,2-11H2,1H3
InChIKeyVNYRXLRNQWQECH-UHFFFAOYSA-N
MW253.39 g/mol
LogP1.12
Rot. Bonds5

About 2-(1-piperidin-2-ylpropan-2-ylamino)-1-pyrrolidin-1-ylethanone

2-(1-piperidin-2-ylpropan-2-ylamino)-1-pyrrolidin-1-ylethanone (PubChem CID 113405923) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is 2-(1-piperidin-2-ylpropan-2-ylamino)-1-pyrrolidin-1-ylethanone.

Molecular Properties

Compound Name2-(1-piperidin-2-ylpropan-2-ylamino)-1-pyrrolidin-1-ylethanone
PubChem CID113405923
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC Name2-(1-piperidin-2-ylpropan-2-ylamino)-1-pyrrolidin-1-ylethanone
SMILESCC(CC1CCCCN1)NCC(=O)N1CCCC1
InChIInChI=1S/C14H27N3O/c1-12(10-13-6-2-3-7-15-13)16-11-14(18)17-8-4-5-9-17/h12-13,15-16H,2-11H2,1H3
InChIKeyVNYRXLRNQWQECH-UHFFFAOYSA-N
XLogP1.12
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-(azepan-2-yl)propan-2-ylamino]-N-cyclopropylacetamide
CID 79560216
2-(1-pyrrolidin-2-ylpropan-2-ylamino)acetamide
CID 79544229
2-[(2S)-piperidin-2-yl]-1-pyrrolidin-1-ylethanone
CID 29083930
N-methyl-2-(1-pyrrolidin-2-ylpropan-2-ylamino)acetamide
CID 79541394
1-(azepan-2-yl)-N-[2-(azepan-1-yl)ethyl]propan-2-amine
CID 79560062
4-(1-piperidin-2-ylpropan-2-ylamino)butan-1-ol
CID 106840824
1-piperidin-2-yl-N-(3-pyrrolidin-1-ylpropyl)propan-2-amine
CID 79549233
1-piperidin-2-yl-N-(2,2,2-trifluoroethyl)propan-2-amine
CID 79549593
5-(1-piperidin-2-ylpropan-2-ylamino)pentan-1-ol
CID 107316724
N-[1-(azepan-2-yl)propan-2-yl]-2-methylpropan-1-amine
CID 79553512
3-[1-(azepan-2-yl)propan-2-ylamino]-2,2-dimethylpropanamide
CID 106274610
ethyl 3-(1-piperidin-2-ylpropan-2-ylamino)propanoate
CID 79538171

Frequently Asked Questions

What is the IUPAC name of 2-(1-piperidin-2-ylpropan-2-ylamino)-1-pyrrolidin-1-ylethanone?
The IUPAC name of 2-(1-piperidin-2-ylpropan-2-ylamino)-1-pyrrolidin-1-ylethanone (CID 113405923) is 2-(1-piperidin-2-ylpropan-2-ylamino)-1-pyrrolidin-1-ylethanone.
What is the SMILES notation for 2-(1-piperidin-2-ylpropan-2-ylamino)-1-pyrrolidin-1-ylethanone?
The canonical SMILES for 2-(1-piperidin-2-ylpropan-2-ylamino)-1-pyrrolidin-1-ylethanone is CC(CC1CCCCN1)NCC(=O)N1CCCC1.
What is the InChIKey of 2-(1-piperidin-2-ylpropan-2-ylamino)-1-pyrrolidin-1-ylethanone?
The InChIKey is VNYRXLRNQWQECH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O/c1-12(10-13-6-2-3-7-15-13)16-11-14(18)17-8-4-5-9-17/h12-13,15-16H,2-11H2,1H3.
What are the key properties of 2-(1-piperidin-2-ylpropan-2-ylamino)-1-pyrrolidin-1-ylethanone?
2-(1-piperidin-2-ylpropan-2-ylamino)-1-pyrrolidin-1-ylethanone has a molecular weight of 253.39 g/mol, XLogP of 1.12, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-piperidin-2-ylpropan-2-ylamino)-1-pyrrolidin-1-ylethanone is sourced from PubChem (CID 113405923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).