1-amino-N-[1-(2-methoxyacetyl)piperidin-4-yl]cyclobutane-1-carboxamide

C13H23N3O3 — CID 81178645

IUPAC1-amino-N-[1-(2-methoxyacetyl)piperidin-4-yl]cyclobutane-1-carboxamide
SMILESCOCC(=O)N1CCC(NC(=O)C2(N)CCC2)CC1
InChIInChI=1S/C13H23N3O3/c1-19-9-11(17)16-7-3-10(4-8-16)15-12(18)13(14)5-2-6-13/h10H,2-9,14H2,1H3,(H,15,18)
InChIKeyQTLHCXJKBPFZTC-UHFFFAOYSA-N
MW269.34 g/mol
LogP-0.38
Rot. Bonds4

About 1-amino-N-[1-(2-methoxyacetyl)piperidin-4-yl]cyclobutane-1-carboxamide

1-amino-N-[1-(2-methoxyacetyl)piperidin-4-yl]cyclobutane-1-carboxamide (PubChem CID 81178645) has the molecular formula C13H23N3O3 and a molecular weight of 269.34 g/mol. Its IUPAC name is 1-amino-N-[1-(2-methoxyacetyl)piperidin-4-yl]cyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-[1-(2-methoxyacetyl)piperidin-4-yl]cyclobutane-1-carboxamide
PubChem CID81178645
Molecular FormulaC13H23N3O3
Molecular Weight269.34 g/mol
Exact Mass269.17
IUPAC Name1-amino-N-[1-(2-methoxyacetyl)piperidin-4-yl]cyclobutane-1-carboxamide
SMILESCOCC(=O)N1CCC(NC(=O)C2(N)CCC2)CC1
InChIInChI=1S/C13H23N3O3/c1-19-9-11(17)16-7-3-10(4-8-16)15-12(18)13(14)5-2-6-13/h10H,2-9,14H2,1H3,(H,15,18)
InChIKeyQTLHCXJKBPFZTC-UHFFFAOYSA-N
XLogP-0.38
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 5-0.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-amino-N-[1-(3-methylbutanoyl)piperidin-4-yl]cyclopentane-1-carboxamide
CID 119307388
N-[1-(2-methoxyacetyl)piperidin-4-yl]-4-methylpiperidine-4-carboxamide
CID 63121640
2-amino-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide
CID 43711839
1-[(1-hydroxycyclobutyl)methyl]-3-[1-(2-methoxyacetyl)piperidin-4-yl]-2-methylguanidine
CID 119156095
2-methoxy-1-[4-(propan-2-ylamino)piperidin-1-yl]ethanone
CID 43747632
1-[4-(1-aminocyclobutanecarbonyl)piperazin-1-yl]-2-methoxyethanone
CID 81172336
2-amino-N-[1-(2-methoxyacetyl)piperidin-4-yl]-2-methylpropanamide
CID 61266193
2-bromo-N-[1-(2-methoxyacetyl)piperidin-4-yl]acetamide
CID 63681407
2-amino-3-methoxy-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide
CID 81083241
N-[1-(1-aminocyclopropanecarbonyl)piperidin-4-yl]-2-methoxyacetamide
CID 65466624
1-amino-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]cyclopentane-1-carboxamide;hydrochloride
CID 119278564
1-[4-(1-aminocyclopentanecarbonyl)piperazin-1-yl]-2-methoxyethanone
CID 54872234

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[1-(2-methoxyacetyl)piperidin-4-yl]cyclobutane-1-carboxamide?
The IUPAC name of 1-amino-N-[1-(2-methoxyacetyl)piperidin-4-yl]cyclobutane-1-carboxamide (CID 81178645) is 1-amino-N-[1-(2-methoxyacetyl)piperidin-4-yl]cyclobutane-1-carboxamide.
What is the SMILES notation for 1-amino-N-[1-(2-methoxyacetyl)piperidin-4-yl]cyclobutane-1-carboxamide?
The canonical SMILES for 1-amino-N-[1-(2-methoxyacetyl)piperidin-4-yl]cyclobutane-1-carboxamide is COCC(=O)N1CCC(NC(=O)C2(N)CCC2)CC1.
What is the InChIKey of 1-amino-N-[1-(2-methoxyacetyl)piperidin-4-yl]cyclobutane-1-carboxamide?
The InChIKey is QTLHCXJKBPFZTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O3/c1-19-9-11(17)16-7-3-10(4-8-16)15-12(18)13(14)5-2-6-13/h10H,2-9,14H2,1H3,(H,15,18).
What are the key properties of 1-amino-N-[1-(2-methoxyacetyl)piperidin-4-yl]cyclobutane-1-carboxamide?
1-amino-N-[1-(2-methoxyacetyl)piperidin-4-yl]cyclobutane-1-carboxamide has a molecular weight of 269.34 g/mol, XLogP of -0.38, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[1-(2-methoxyacetyl)piperidin-4-yl]cyclobutane-1-carboxamide is sourced from PubChem (CID 81178645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).