4-amino-N-(1-cyclohexylpropyl)-3-methyloxolane-3-carboxamide

C15H28N2O2 — CID 66263325

IUPAC4-amino-N-(1-cyclohexylpropyl)-3-methyloxolane-3-carboxamide
SMILESCCC(NC(=O)C1(C)COCC1N)C1CCCCC1
InChIInChI=1S/C15H28N2O2/c1-3-12(11-7-5-4-6-8-11)17-14(18)15(2)10-19-9-13(15)16/h11-13H,3-10,16H2,1-2H3,(H,17,18)
InChIKeyGSPHJCGTPYAYSE-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.83
Rot. Bonds4

About 4-amino-N-(1-cyclohexylpropyl)-3-methyloxolane-3-carboxamide

4-amino-N-(1-cyclohexylpropyl)-3-methyloxolane-3-carboxamide (PubChem CID 66263325) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 4-amino-N-(1-cyclohexylpropyl)-3-methyloxolane-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(1-cyclohexylpropyl)-3-methyloxolane-3-carboxamide
PubChem CID66263325
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name4-amino-N-(1-cyclohexylpropyl)-3-methyloxolane-3-carboxamide
SMILESCCC(NC(=O)C1(C)COCC1N)C1CCCCC1
InChIInChI=1S/C15H28N2O2/c1-3-12(11-7-5-4-6-8-11)17-14(18)15(2)10-19-9-13(15)16/h11-13H,3-10,16H2,1-2H3,(H,17,18)
InChIKeyGSPHJCGTPYAYSE-UHFFFAOYSA-N
XLogP1.83
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-(dicyclopropylmethyl)-3-methyloxolane-3-carboxamide
CID 66250852
4-amino-3-methyl-N-(4-methylhexan-2-yl)oxolane-3-carboxamide
CID 66264615
(2S)-2-[(4-amino-3-methyloxolane-3-carbonyl)amino]pentanoic acid
CID 107565154
4-amino-N-(1-hydroxy-3-methylbutan-2-yl)-3-methyloxolane-3-carboxamide
CID 79249257
4-amino-N-(2-ethylcyclohexyl)-3-methyloxolane-3-carboxamide
CID 66248852
methyl (2S)-2-[(4-amino-3-methyloxolane-3-carbonyl)amino]propanoate
CID 66249249
4-amino-N-(1-cyclohexylpropyl)oxolane-3-carboxamide
CID 66237697
(2S)-4-amino-2-[(4-amino-3-methyloxolane-3-carbonyl)amino]-4-oxobutanoic acid
CID 114005176
4-amino-N-(3-ethyl-2-hydroxypentyl)-3-methyloxolane-3-carboxamide
CID 106286460
N-(1-cyclohexylpropyl)-1-(N'-hydroxycarbamimidoyl)cyclopropane-1-carboxamide
CID 80596824
4-amino-N-(1,1-dimethoxypropan-2-yl)-3-methyloxolane-3-carboxamide
CID 66262770
N-(1-cyclohexylpropyl)acetamide
CID 45119320

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(1-cyclohexylpropyl)-3-methyloxolane-3-carboxamide?
The IUPAC name of 4-amino-N-(1-cyclohexylpropyl)-3-methyloxolane-3-carboxamide (CID 66263325) is 4-amino-N-(1-cyclohexylpropyl)-3-methyloxolane-3-carboxamide.
What is the SMILES notation for 4-amino-N-(1-cyclohexylpropyl)-3-methyloxolane-3-carboxamide?
The canonical SMILES for 4-amino-N-(1-cyclohexylpropyl)-3-methyloxolane-3-carboxamide is CCC(NC(=O)C1(C)COCC1N)C1CCCCC1.
What is the InChIKey of 4-amino-N-(1-cyclohexylpropyl)-3-methyloxolane-3-carboxamide?
The InChIKey is GSPHJCGTPYAYSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-3-12(11-7-5-4-6-8-11)17-14(18)15(2)10-19-9-13(15)16/h11-13H,3-10,16H2,1-2H3,(H,17,18).
What are the key properties of 4-amino-N-(1-cyclohexylpropyl)-3-methyloxolane-3-carboxamide?
4-amino-N-(1-cyclohexylpropyl)-3-methyloxolane-3-carboxamide has a molecular weight of 268.40 g/mol, XLogP of 1.83, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(1-cyclohexylpropyl)-3-methyloxolane-3-carboxamide is sourced from PubChem (CID 66263325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).