N-[4-(propylamino)cyclohexyl]oxolane-2-carboxamide

C14H26N2O2 — CID 43653441

IUPACN-[4-(propylamino)cyclohexyl]oxolane-2-carboxamide
SMILESCCCNC1CCC(NC(=O)C2CCCO2)CC1
InChIInChI=1S/C14H26N2O2/c1-2-9-15-11-5-7-12(8-6-11)16-14(17)13-4-3-10-18-13/h11-13,15H,2-10H2,1H3,(H,16,17)
InChIKeySGGXHTIZRPKPSX-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.59
Rot. Bonds5

About N-[4-(propylamino)cyclohexyl]oxolane-2-carboxamide

N-[4-(propylamino)cyclohexyl]oxolane-2-carboxamide (PubChem CID 43653441) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is N-[4-(propylamino)cyclohexyl]oxolane-2-carboxamide.

Molecular Properties

Compound NameN-[4-(propylamino)cyclohexyl]oxolane-2-carboxamide
PubChem CID43653441
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC NameN-[4-(propylamino)cyclohexyl]oxolane-2-carboxamide
SMILESCCCNC1CCC(NC(=O)C2CCCO2)CC1
InChIInChI=1S/C14H26N2O2/c1-2-9-15-11-5-7-12(8-6-11)16-14(17)13-4-3-10-18-13/h11-13,15H,2-10H2,1H3,(H,16,17)
InChIKeySGGXHTIZRPKPSX-UHFFFAOYSA-N
XLogP1.59
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[4-(propylamino)cyclohexyl]oxolane-2-carboxamide?
The IUPAC name of N-[4-(propylamino)cyclohexyl]oxolane-2-carboxamide (CID 43653441) is N-[4-(propylamino)cyclohexyl]oxolane-2-carboxamide.
What is the SMILES notation for N-[4-(propylamino)cyclohexyl]oxolane-2-carboxamide?
The canonical SMILES for N-[4-(propylamino)cyclohexyl]oxolane-2-carboxamide is CCCNC1CCC(NC(=O)C2CCCO2)CC1.
What is the InChIKey of N-[4-(propylamino)cyclohexyl]oxolane-2-carboxamide?
The InChIKey is SGGXHTIZRPKPSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-2-9-15-11-5-7-12(8-6-11)16-14(17)13-4-3-10-18-13/h11-13,15H,2-10H2,1H3,(H,16,17).
What are the key properties of N-[4-(propylamino)cyclohexyl]oxolane-2-carboxamide?
N-[4-(propylamino)cyclohexyl]oxolane-2-carboxamide has a molecular weight of 254.37 g/mol, XLogP of 1.59, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(propylamino)cyclohexyl]oxolane-2-carboxamide is sourced from PubChem (CID 43653441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).