3-[(2-piperidin-4-ylacetyl)amino]-N-propan-2-ylpropanamide

C13H25N3O2 — CID 113266104

IUPAC3-[(2-piperidin-4-ylacetyl)amino]-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)CCNC(=O)CC1CCNCC1
InChIInChI=1S/C13H25N3O2/c1-10(2)16-12(17)5-8-15-13(18)9-11-3-6-14-7-4-11/h10-11,14H,3-9H2,1-2H3,(H,15,18)(H,16,17)
InChIKeyMKKXPRPJWYCQCB-UHFFFAOYSA-N
MW255.36 g/mol
LogP0.41
Rot. Bonds6

About 3-[(2-piperidin-4-ylacetyl)amino]-N-propan-2-ylpropanamide

3-[(2-piperidin-4-ylacetyl)amino]-N-propan-2-ylpropanamide (PubChem CID 113266104) has the molecular formula C13H25N3O2 and a molecular weight of 255.36 g/mol. Its IUPAC name is 3-[(2-piperidin-4-ylacetyl)amino]-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name3-[(2-piperidin-4-ylacetyl)amino]-N-propan-2-ylpropanamide
PubChem CID113266104
Molecular FormulaC13H25N3O2
Molecular Weight255.36 g/mol
Exact Mass255.19
IUPAC Name3-[(2-piperidin-4-ylacetyl)amino]-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)CCNC(=O)CC1CCNCC1
InChIInChI=1S/C13H25N3O2/c1-10(2)16-12(17)5-8-15-13(18)9-11-3-6-14-7-4-11/h10-11,14H,3-9H2,1-2H3,(H,15,18)(H,16,17)
InChIKeyMKKXPRPJWYCQCB-UHFFFAOYSA-N
XLogP0.41
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 50.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-piperidin-4-ylacetyl)amino]-N-propylpropanamide
CID 54980022
2-(azetidin-3-yl)-N-propan-2-ylacetamide
CID 64616125
3-(cyclopropylamino)-N-[3-oxo-3-(propan-2-ylamino)propyl]propanamide
CID 113410047
N-[(2S)-2-methylsulfanylpropyl]-2-piperidin-4-ylacetamide
CID 99596160
3-[[2-(4-aminocyclohexyl)acetyl]amino]-N-butan-2-ylpropanamide
CID 62781746
N-(4-hydroxybutan-2-yl)-2-piperidin-4-ylacetamide
CID 83177313
N-(4-methylpentan-2-yl)-2-piperidin-4-ylacetamide
CID 43372444
3-[(2-cyclopentylacetyl)amino]-N-propylpropanamide
CID 167068164
2-cycloheptyl-N-(piperidin-4-ylmethyl)acetamide
CID 115736681
2-piperidin-4-yl-N-prop-2-ynylacetamide
CID 61028682
N-[3-(diethylamino)propyl]-2-piperidin-4-ylacetamide
CID 24707221
N-[2-[(2-cyclohexylacetyl)amino]ethyl]piperidine-4-carboxamide
CID 119313809

Frequently Asked Questions

What is the IUPAC name of 3-[(2-piperidin-4-ylacetyl)amino]-N-propan-2-ylpropanamide?
The IUPAC name of 3-[(2-piperidin-4-ylacetyl)amino]-N-propan-2-ylpropanamide (CID 113266104) is 3-[(2-piperidin-4-ylacetyl)amino]-N-propan-2-ylpropanamide.
What is the SMILES notation for 3-[(2-piperidin-4-ylacetyl)amino]-N-propan-2-ylpropanamide?
The canonical SMILES for 3-[(2-piperidin-4-ylacetyl)amino]-N-propan-2-ylpropanamide is CC(C)NC(=O)CCNC(=O)CC1CCNCC1.
What is the InChIKey of 3-[(2-piperidin-4-ylacetyl)amino]-N-propan-2-ylpropanamide?
The InChIKey is MKKXPRPJWYCQCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2/c1-10(2)16-12(17)5-8-15-13(18)9-11-3-6-14-7-4-11/h10-11,14H,3-9H2,1-2H3,(H,15,18)(H,16,17).
What are the key properties of 3-[(2-piperidin-4-ylacetyl)amino]-N-propan-2-ylpropanamide?
3-[(2-piperidin-4-ylacetyl)amino]-N-propan-2-ylpropanamide has a molecular weight of 255.36 g/mol, XLogP of 0.41, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-piperidin-4-ylacetyl)amino]-N-propan-2-ylpropanamide is sourced from PubChem (CID 113266104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).