N-[4-[[(1R)-1-[(2R)-oxolan-2-yl]propyl]amino]cyclohexyl]acetamide

C15H28N2O2 — CID 99634980

IUPACN-[4-[[(1R)-1-[(2R)-oxolan-2-yl]propyl]amino]cyclohexyl]acetamide
SMILESCC[C@@H](NC1CCC(NC(C)=O)CC1)[C@H]1CCCO1
InChIInChI=1S/C15H28N2O2/c1-3-14(15-5-4-10-19-15)17-13-8-6-12(7-9-13)16-11(2)18/h12-15,17H,3-10H2,1-2H3,(H,16,18)/t12?,13?,14-,15-/m1/s1
InChIKeyXYHPBYKTNMMLEK-NEXFUWMNSA-N
MW268.40 g/mol
LogP1.98
Rot. Bonds5

About N-[4-[[(1R)-1-[(2R)-oxolan-2-yl]propyl]amino]cyclohexyl]acetamide

N-[4-[[(1R)-1-[(2R)-oxolan-2-yl]propyl]amino]cyclohexyl]acetamide (PubChem CID 99634980) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is N-[4-[[(1R)-1-[(2R)-oxolan-2-yl]propyl]amino]cyclohexyl]acetamide.

Molecular Properties

Compound NameN-[4-[[(1R)-1-[(2R)-oxolan-2-yl]propyl]amino]cyclohexyl]acetamide
PubChem CID99634980
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC NameN-[4-[[(1R)-1-[(2R)-oxolan-2-yl]propyl]amino]cyclohexyl]acetamide
SMILESCC[C@@H](NC1CCC(NC(C)=O)CC1)[C@H]1CCCO1
InChIInChI=1S/C15H28N2O2/c1-3-14(15-5-4-10-19-15)17-13-8-6-12(7-9-13)16-11(2)18/h12-15,17H,3-10H2,1-2H3,(H,16,18)/t12?,13?,14-,15-/m1/s1
InChIKeyXYHPBYKTNMMLEK-NEXFUWMNSA-N
XLogP1.98
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-N-[1-(oxolan-2-yl)propyl]cyclohexan-1-amine
CID 115896540
N-[1-(oxolan-2-yl)propyl]cycloheptanamine
CID 115896557
N-[1-(oxolan-2-yl)propyl]acetamide
CID 130615261
1-(1-ethylpiperidin-4-yl)-3-[(1S)-1-[(2R)-oxolan-2-yl]propyl]urea
CID 97244266
2-methyl-N-[1-(oxolan-2-yl)propyl]cyclopentan-1-amine
CID 115896561
tert-butyl N-[1-(oxolan-2-yl)propyl]carbamate
CID 90885725
N-methyl-3-[1-(oxolan-2-yl)propylamino]butanamide
CID 115896542
2-[1-(oxolan-2-yl)propylcarbamoyl]cyclopropane-1-carboxylic acid
CID 120696096
2-(cyclopropylamino)-2-(oxolan-2-yl)acetamide
CID 82837879
(2S)-2-ethyl-2-methyl-N-[(1S)-1-[(2R)-oxolan-2-yl]propyl]morpholine-4-carboxamide
CID 129399538
1-[(3S)-hex-5-en-3-yl]-3-[(1S)-1-[(2S)-oxolan-2-yl]propyl]urea
CID 129433389
N-[3-hydroxy-1-(oxolan-2-yl)propyl]-2-methylprop-2-enamide
CID 178173984

Frequently Asked Questions

What is the IUPAC name of N-[4-[[(1R)-1-[(2R)-oxolan-2-yl]propyl]amino]cyclohexyl]acetamide?
The IUPAC name of N-[4-[[(1R)-1-[(2R)-oxolan-2-yl]propyl]amino]cyclohexyl]acetamide (CID 99634980) is N-[4-[[(1R)-1-[(2R)-oxolan-2-yl]propyl]amino]cyclohexyl]acetamide.
What is the SMILES notation for N-[4-[[(1R)-1-[(2R)-oxolan-2-yl]propyl]amino]cyclohexyl]acetamide?
The canonical SMILES for N-[4-[[(1R)-1-[(2R)-oxolan-2-yl]propyl]amino]cyclohexyl]acetamide is CC[C@@H](NC1CCC(NC(C)=O)CC1)[C@H]1CCCO1.
What is the InChIKey of N-[4-[[(1R)-1-[(2R)-oxolan-2-yl]propyl]amino]cyclohexyl]acetamide?
The InChIKey is XYHPBYKTNMMLEK-NEXFUWMNSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-3-14(15-5-4-10-19-15)17-13-8-6-12(7-9-13)16-11(2)18/h12-15,17H,3-10H2,1-2H3,(H,16,18)/t12?,13?,14-,15-/m1/s1.
What are the key properties of N-[4-[[(1R)-1-[(2R)-oxolan-2-yl]propyl]amino]cyclohexyl]acetamide?
N-[4-[[(1R)-1-[(2R)-oxolan-2-yl]propyl]amino]cyclohexyl]acetamide has a molecular weight of 268.40 g/mol, XLogP of 1.98, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[(1R)-1-[(2R)-oxolan-2-yl]propyl]amino]cyclohexyl]acetamide is sourced from PubChem (CID 99634980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).