N-butyl-N-cyclopropyl-4-(propylamino)oxolane-3-carboxamide

C15H28N2O2 — CID 66257100

IUPACN-butyl-N-cyclopropyl-4-(propylamino)oxolane-3-carboxamide
SMILESCCCCN(C(=O)C1COCC1NCCC)C1CC1
InChIInChI=1S/C15H28N2O2/c1-3-5-9-17(12-6-7-12)15(18)13-10-19-11-14(13)16-8-4-2/h12-14,16H,3-11H2,1-2H3
InChIKeyNHTMKPQLDJXKQD-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.79
Rot. Bonds8

About N-butyl-N-cyclopropyl-4-(propylamino)oxolane-3-carboxamide

N-butyl-N-cyclopropyl-4-(propylamino)oxolane-3-carboxamide (PubChem CID 66257100) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is N-butyl-N-cyclopropyl-4-(propylamino)oxolane-3-carboxamide.

Molecular Properties

Compound NameN-butyl-N-cyclopropyl-4-(propylamino)oxolane-3-carboxamide
PubChem CID66257100
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC NameN-butyl-N-cyclopropyl-4-(propylamino)oxolane-3-carboxamide
SMILESCCCCN(C(=O)C1COCC1NCCC)C1CC1
InChIInChI=1S/C15H28N2O2/c1-3-5-9-17(12-6-7-12)15(18)13-10-19-11-14(13)16-8-4-2/h12-14,16H,3-11H2,1-2H3
InChIKeyNHTMKPQLDJXKQD-UHFFFAOYSA-N
XLogP1.79
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-butyl-N-cyclopropyl-4-(ethylamino)oxolane-3-carboxamide
CID 66259844
N-cyclopentyl-N-(2-hydroxyethyl)-4-(propylamino)oxolane-3-carboxamide
CID 66255005
2-[propyl-[4-(propylamino)oxolane-3-carbonyl]amino]acetic acid
CID 66256929
N-cyclohexyl-N-methyl-4-(propylamino)oxolane-3-carboxamide
CID 66257070
1-[4-(propylamino)oxolan-3-yl]pentan-1-one
CID 116587714
2-[methyl-[4-(propylamino)oxolane-3-carbonyl]amino]propanoic acid
CID 66255984
N-(2-methoxyethyl)-N-methyl-4-(propylamino)oxolane-3-carboxamide
CID 66254816
1-[4-(propylamino)oxolan-3-yl]undecan-1-one
CID 116587751
cyclopropyl-[4-(propylamino)oxolan-3-yl]methanone
CID 116587886
2-[methyl-[4-(propylamino)oxolane-3-carbonyl]amino]butanoic acid
CID 66256930
N-methyl-N-[3-(methylamino)-3-oxopropyl]-4-(propylamino)oxolane-3-carboxamide
CID 106915220
N-(1,1-dioxothiolan-3-yl)-N-methyl-4-(propylamino)oxolane-3-carboxamide
CID 66255940

Frequently Asked Questions

What is the IUPAC name of N-butyl-N-cyclopropyl-4-(propylamino)oxolane-3-carboxamide?
The IUPAC name of N-butyl-N-cyclopropyl-4-(propylamino)oxolane-3-carboxamide (CID 66257100) is N-butyl-N-cyclopropyl-4-(propylamino)oxolane-3-carboxamide.
What is the SMILES notation for N-butyl-N-cyclopropyl-4-(propylamino)oxolane-3-carboxamide?
The canonical SMILES for N-butyl-N-cyclopropyl-4-(propylamino)oxolane-3-carboxamide is CCCCN(C(=O)C1COCC1NCCC)C1CC1.
What is the InChIKey of N-butyl-N-cyclopropyl-4-(propylamino)oxolane-3-carboxamide?
The InChIKey is NHTMKPQLDJXKQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-3-5-9-17(12-6-7-12)15(18)13-10-19-11-14(13)16-8-4-2/h12-14,16H,3-11H2,1-2H3.
What are the key properties of N-butyl-N-cyclopropyl-4-(propylamino)oxolane-3-carboxamide?
N-butyl-N-cyclopropyl-4-(propylamino)oxolane-3-carboxamide has a molecular weight of 268.40 g/mol, XLogP of 1.79, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-cyclopropyl-4-(propylamino)oxolane-3-carboxamide is sourced from PubChem (CID 66257100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).