2-(butan-2-ylamino)-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]acetamide

C15H27N3O2 — CID 60853761

IUPAC2-(butan-2-ylamino)-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]acetamide
SMILESCCC(C)NCC(=O)NC1CCN(C(=O)C2CC2)CC1
InChIInChI=1S/C15H27N3O2/c1-3-11(2)16-10-14(19)17-13-6-8-18(9-7-13)15(20)12-4-5-12/h11-13,16H,3-10H2,1-2H3,(H,17,19)
InChIKeyXDTODYMXOPIFSE-UHFFFAOYSA-N
MW281.40 g/mol
LogP0.89
Rot. Bonds6

About 2-(butan-2-ylamino)-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]acetamide

2-(butan-2-ylamino)-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]acetamide (PubChem CID 60853761) has the molecular formula C15H27N3O2 and a molecular weight of 281.40 g/mol. Its IUPAC name is 2-(butan-2-ylamino)-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]acetamide.

Molecular Properties

Compound Name2-(butan-2-ylamino)-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]acetamide
PubChem CID60853761
Molecular FormulaC15H27N3O2
Molecular Weight281.40 g/mol
Exact Mass281.21
IUPAC Name2-(butan-2-ylamino)-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]acetamide
SMILESCCC(C)NCC(=O)NC1CCN(C(=O)C2CC2)CC1
InChIInChI=1S/C15H27N3O2/c1-3-11(2)16-10-14(19)17-13-6-8-18(9-7-13)15(20)12-4-5-12/h11-13,16H,3-10H2,1-2H3,(H,17,19)
InChIKeyXDTODYMXOPIFSE-UHFFFAOYSA-N
XLogP0.89
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(butan-2-ylamino)-N-(4-hydroxycyclohexyl)acetamide
CID 60852285
N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-3-(propan-2-ylamino)propanamide
CID 60853818
cyclopropyl-[4-(pentan-3-ylamino)piperidin-1-yl]methanone
CID 43747893
N-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]propanamide
CID 110871450
N-cyclopentyl-2-(1-pyrrolidin-1-ylpropan-2-ylamino)acetamide
CID 54952745
3-[[2-(butan-2-ylamino)acetyl]amino]cyclohexane-1-carboxylic acid
CID 63043134
2-(butan-2-ylamino)-N-(oxolan-3-yl)acetamide
CID 80713915
2-(butan-2-ylamino)-N-(3,3-dimethylcyclopentyl)acetamide
CID 114546344
2-amino-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]pentanamide
CID 43711915
cyclopropyl-[4-(methylamino)piperidin-1-yl]methanone
CID 60817866
ethyl 4-[[1-(cyclopropanecarbonyl)piperidine-4-carbonyl]amino]piperidine-1-carboxylate
CID 51165095
2-[[N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N'-methylcarbamimidoyl]amino]-N-propan-2-ylacetamide
CID 119158319

Frequently Asked Questions

What is the IUPAC name of 2-(butan-2-ylamino)-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]acetamide?
The IUPAC name of 2-(butan-2-ylamino)-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]acetamide (CID 60853761) is 2-(butan-2-ylamino)-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]acetamide.
What is the SMILES notation for 2-(butan-2-ylamino)-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]acetamide?
The canonical SMILES for 2-(butan-2-ylamino)-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]acetamide is CCC(C)NCC(=O)NC1CCN(C(=O)C2CC2)CC1.
What is the InChIKey of 2-(butan-2-ylamino)-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]acetamide?
The InChIKey is XDTODYMXOPIFSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O2/c1-3-11(2)16-10-14(19)17-13-6-8-18(9-7-13)15(20)12-4-5-12/h11-13,16H,3-10H2,1-2H3,(H,17,19).
What are the key properties of 2-(butan-2-ylamino)-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]acetamide?
2-(butan-2-ylamino)-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]acetamide has a molecular weight of 281.40 g/mol, XLogP of 0.89, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(butan-2-ylamino)-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]acetamide is sourced from PubChem (CID 60853761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).