N-[(1-methylcyclopentyl)methyl]-4-(propylamino)oxolane-3-carboxamide

C15H28N2O2 — CID 66257137

IUPACN-[(1-methylcyclopentyl)methyl]-4-(propylamino)oxolane-3-carboxamide
SMILESCCCNC1COCC1C(=O)NCC1(C)CCCC1
InChIInChI=1S/C15H28N2O2/c1-3-8-16-13-10-19-9-12(13)14(18)17-11-15(2)6-4-5-7-15/h12-13,16H,3-11H2,1-2H3,(H,17,18)
InChIKeyXWBXKRTVLIFWLW-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.70
Rot. Bonds6

About N-[(1-methylcyclopentyl)methyl]-4-(propylamino)oxolane-3-carboxamide

N-[(1-methylcyclopentyl)methyl]-4-(propylamino)oxolane-3-carboxamide (PubChem CID 66257137) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is N-[(1-methylcyclopentyl)methyl]-4-(propylamino)oxolane-3-carboxamide.

Molecular Properties

Compound NameN-[(1-methylcyclopentyl)methyl]-4-(propylamino)oxolane-3-carboxamide
PubChem CID66257137
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC NameN-[(1-methylcyclopentyl)methyl]-4-(propylamino)oxolane-3-carboxamide
SMILESCCCNC1COCC1C(=O)NCC1(C)CCCC1
InChIInChI=1S/C15H28N2O2/c1-3-8-16-13-10-19-9-12(13)14(18)17-11-15(2)6-4-5-7-15/h12-13,16H,3-11H2,1-2H3,(H,17,18)
InChIKeyXWBXKRTVLIFWLW-UHFFFAOYSA-N
XLogP1.70
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[1-(dimethylamino)cyclopentyl]methyl]-4-(propylamino)oxolane-3-carboxamide
CID 83112481
N-(1-methylcyclopentyl)-4-(propylamino)oxolane-3-carboxamide
CID 66255020
4-(propylamino)-N-(3,3,3-trifluoropropyl)oxolane-3-carboxamide
CID 66257134
N-[2-(carbamoylamino)ethyl]-4-(propylamino)oxolane-3-carboxamide
CID 83110182
N-propan-2-yl-4-(propylamino)oxolane-3-carboxamide
CID 66254772
N-(2-cyclopropylethyl)-4-(propylamino)oxolane-3-carboxamide
CID 66256756
4-(ethylamino)-N-[[1-(hydroxymethyl)cyclohexyl]methyl]oxolane-3-carboxamide
CID 103966758
N-[2-(dimethylcarbamoylamino)ethyl]-4-(propylamino)oxolane-3-carboxamide
CID 83110481
N-[(2-methylcyclopentyl)methyl]-4-(propylamino)oxolane-3-carboxamide
CID 107418568
N-(2,2-difluoro-3-hydroxypropyl)-4-(propylamino)oxolane-3-carboxamide
CID 114154209
N-(2,2-dimethoxyethyl)-4-(propylamino)oxolane-3-carboxamide
CID 66255397
N-(oxan-3-ylmethyl)-4-(propylamino)oxolane-3-carboxamide
CID 66256717

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylcyclopentyl)methyl]-4-(propylamino)oxolane-3-carboxamide?
The IUPAC name of N-[(1-methylcyclopentyl)methyl]-4-(propylamino)oxolane-3-carboxamide (CID 66257137) is N-[(1-methylcyclopentyl)methyl]-4-(propylamino)oxolane-3-carboxamide.
What is the SMILES notation for N-[(1-methylcyclopentyl)methyl]-4-(propylamino)oxolane-3-carboxamide?
The canonical SMILES for N-[(1-methylcyclopentyl)methyl]-4-(propylamino)oxolane-3-carboxamide is CCCNC1COCC1C(=O)NCC1(C)CCCC1.
What is the InChIKey of N-[(1-methylcyclopentyl)methyl]-4-(propylamino)oxolane-3-carboxamide?
The InChIKey is XWBXKRTVLIFWLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-3-8-16-13-10-19-9-12(13)14(18)17-11-15(2)6-4-5-7-15/h12-13,16H,3-11H2,1-2H3,(H,17,18).
What are the key properties of N-[(1-methylcyclopentyl)methyl]-4-(propylamino)oxolane-3-carboxamide?
N-[(1-methylcyclopentyl)methyl]-4-(propylamino)oxolane-3-carboxamide has a molecular weight of 268.40 g/mol, XLogP of 1.70, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylcyclopentyl)methyl]-4-(propylamino)oxolane-3-carboxamide is sourced from PubChem (CID 66257137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).