(2R)-2-amino-1-[4-(oxolane-2-carbonyl)piperazin-1-yl]pentan-1-one

C14H25N3O3 — CID 103793993

IUPAC(2R)-2-amino-1-[4-(oxolane-2-carbonyl)piperazin-1-yl]pentan-1-one
SMILESCCC[C@@H](N)C(=O)N1CCN(C(=O)C2CCCO2)CC1
InChIInChI=1S/C14H25N3O3/c1-2-4-11(15)13(18)16-6-8-17(9-7-16)14(19)12-5-3-10-20-12/h11-12H,2-10,15H2,1H3/t11-,12?/m1/s1
InChIKeyYNAKFGYAMKPBKO-JHJMLUEUSA-N
MW283.37 g/mol
LogP-0.04
Rot. Bonds4

About (2R)-2-amino-1-[4-(oxolane-2-carbonyl)piperazin-1-yl]pentan-1-one

(2R)-2-amino-1-[4-(oxolane-2-carbonyl)piperazin-1-yl]pentan-1-one (PubChem CID 103793993) has the molecular formula C14H25N3O3 and a molecular weight of 283.37 g/mol. Its IUPAC name is (2R)-2-amino-1-[4-(oxolane-2-carbonyl)piperazin-1-yl]pentan-1-one.

Molecular Properties

Compound Name(2R)-2-amino-1-[4-(oxolane-2-carbonyl)piperazin-1-yl]pentan-1-one
PubChem CID103793993
Molecular FormulaC14H25N3O3
Molecular Weight283.37 g/mol
Exact Mass283.19
IUPAC Name(2R)-2-amino-1-[4-(oxolane-2-carbonyl)piperazin-1-yl]pentan-1-one
SMILESCCC[C@@H](N)C(=O)N1CCN(C(=O)C2CCCO2)CC1
InChIInChI=1S/C14H25N3O3/c1-2-4-11(15)13(18)16-6-8-17(9-7-16)14(19)12-5-3-10-20-12/h11-12H,2-10,15H2,1H3/t11-,12?/m1/s1
InChIKeyYNAKFGYAMKPBKO-JHJMLUEUSA-N
XLogP-0.04
TPSA75.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 5-0.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl (2R)-2-[4-[(2R)-oxolane-2-carbonyl]piperazin-1-yl]pentanoate
CID 95346669
4-[(2S)-2-aminopentanoyl]morpholine-2-carboxylic acid
CID 107569483
1-[4-(oxolane-2-carbonyl)-1,4-diazepan-1-yl]butan-1-one
CID 110796627
2-methyl-3-(methylamino)-1-[4-(oxolane-2-carbonyl)piperazin-1-yl]propan-1-one
CID 79195456
(4-methanidylpiperazin-1-yl)-(oxolan-2-yl)methanone
CID 59620099
ethane;1-[4-(oxolane-2-carbonyl)piperazin-1-yl]ethanone
CID 143678083
[4-(1-aminopropan-2-yl)piperazin-1-yl]-(oxolan-2-yl)methanone
CID 55202925
2-amino-1-(azocan-1-yl)pentan-1-one;hydrochloride
CID 119264220
(2S)-2-amino-1-[(3S)-3-hydroxypiperidin-1-yl]pentan-1-one
CID 93318647
[4-(2-morpholin-4-ylethyl)piperazin-1-yl]-(oxolan-2-yl)methanone
CID 113073657
[4-(3-amino-2-methylpropyl)piperazin-1-yl]-(oxolan-2-yl)methanone
CID 43251966
[(2S)-oxolan-2-yl]-[(4S)-4-propan-2-ylazepan-1-yl]methanone
CID 95627899

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-1-[4-(oxolane-2-carbonyl)piperazin-1-yl]pentan-1-one?
The IUPAC name of (2R)-2-amino-1-[4-(oxolane-2-carbonyl)piperazin-1-yl]pentan-1-one (CID 103793993) is (2R)-2-amino-1-[4-(oxolane-2-carbonyl)piperazin-1-yl]pentan-1-one.
What is the SMILES notation for (2R)-2-amino-1-[4-(oxolane-2-carbonyl)piperazin-1-yl]pentan-1-one?
The canonical SMILES for (2R)-2-amino-1-[4-(oxolane-2-carbonyl)piperazin-1-yl]pentan-1-one is CCC[C@@H](N)C(=O)N1CCN(C(=O)C2CCCO2)CC1.
What is the InChIKey of (2R)-2-amino-1-[4-(oxolane-2-carbonyl)piperazin-1-yl]pentan-1-one?
The InChIKey is YNAKFGYAMKPBKO-JHJMLUEUSA-N. The full InChI is InChI=1S/C14H25N3O3/c1-2-4-11(15)13(18)16-6-8-17(9-7-16)14(19)12-5-3-10-20-12/h11-12H,2-10,15H2,1H3/t11-,12?/m1/s1.
What are the key properties of (2R)-2-amino-1-[4-(oxolane-2-carbonyl)piperazin-1-yl]pentan-1-one?
(2R)-2-amino-1-[4-(oxolane-2-carbonyl)piperazin-1-yl]pentan-1-one has a molecular weight of 283.37 g/mol, XLogP of -0.04, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-1-[4-(oxolane-2-carbonyl)piperazin-1-yl]pentan-1-one is sourced from PubChem (CID 103793993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).