2-[4-(pentan-3-ylamino)piperidin-1-yl]acetamide

C12H25N3O — CID 43746855

IUPAC2-[4-(pentan-3-ylamino)piperidin-1-yl]acetamide
SMILESCCC(CC)NC1CCN(CC(N)=O)CC1
InChIInChI=1S/C12H25N3O/c1-3-10(4-2)14-11-5-7-15(8-6-11)9-12(13)16/h10-11,14H,3-9H2,1-2H3,(H2,13,16)
InChIKeySNTYQFUDGFNQGZ-UHFFFAOYSA-N
MW227.35 g/mol
LogP0.71
Rot. Bonds6

About 2-[4-(pentan-3-ylamino)piperidin-1-yl]acetamide

2-[4-(pentan-3-ylamino)piperidin-1-yl]acetamide (PubChem CID 43746855) has the molecular formula C12H25N3O and a molecular weight of 227.35 g/mol. Its IUPAC name is 2-[4-(pentan-3-ylamino)piperidin-1-yl]acetamide.

Molecular Properties

Compound Name2-[4-(pentan-3-ylamino)piperidin-1-yl]acetamide
PubChem CID43746855
Molecular FormulaC12H25N3O
Molecular Weight227.35 g/mol
Exact Mass227.20
IUPAC Name2-[4-(pentan-3-ylamino)piperidin-1-yl]acetamide
SMILESCCC(CC)NC1CCN(CC(N)=O)CC1
InChIInChI=1S/C12H25N3O/c1-3-10(4-2)14-11-5-7-15(8-6-11)9-12(13)16/h10-11,14H,3-9H2,1-2H3,(H2,13,16)
InChIKeySNTYQFUDGFNQGZ-UHFFFAOYSA-N
XLogP0.71
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

cyclopropyl-[4-(pentan-3-ylamino)piperidin-1-yl]methanone
CID 43747893
2-[4-[(1-propan-2-ylpiperidin-4-yl)amino]piperidin-1-yl]acetamide
CID 43746779
2-[4-(heptan-3-ylamino)piperidin-1-yl]-N-methylacetamide
CID 63944334
2-[3-(methylamino)pyrrolidin-1-yl]acetamide
CID 74958986
2-[4-(1-pyridin-4-ylethylamino)piperidin-1-yl]acetamide
CID 43746847
2-[4-[1-(3,5-dimethylphenyl)ethylamino]piperidin-1-yl]acetamide
CID 81297527
2-(4-ethylpiperidin-1-yl)acetamide
CID 23381133
2-[4-[(3-methylcyclobutyl)amino]piperidin-1-yl]acetamide
CID 104859652
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]prop-2-enamide
CID 43700635
2-[4-(heptan-4-ylamino)piperidin-1-yl]-N-methylacetamide
CID 43691450
2-[4-[1-(4-hydroxyphenyl)propan-2-ylamino]piperidin-1-yl]acetamide
CID 115494179
1-[4-(1-hydroxybutan-2-ylamino)piperidin-1-yl]ethanone
CID 43222767

Frequently Asked Questions

What is the IUPAC name of 2-[4-(pentan-3-ylamino)piperidin-1-yl]acetamide?
The IUPAC name of 2-[4-(pentan-3-ylamino)piperidin-1-yl]acetamide (CID 43746855) is 2-[4-(pentan-3-ylamino)piperidin-1-yl]acetamide.
What is the SMILES notation for 2-[4-(pentan-3-ylamino)piperidin-1-yl]acetamide?
The canonical SMILES for 2-[4-(pentan-3-ylamino)piperidin-1-yl]acetamide is CCC(CC)NC1CCN(CC(N)=O)CC1.
What is the InChIKey of 2-[4-(pentan-3-ylamino)piperidin-1-yl]acetamide?
The InChIKey is SNTYQFUDGFNQGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O/c1-3-10(4-2)14-11-5-7-15(8-6-11)9-12(13)16/h10-11,14H,3-9H2,1-2H3,(H2,13,16).
What are the key properties of 2-[4-(pentan-3-ylamino)piperidin-1-yl]acetamide?
2-[4-(pentan-3-ylamino)piperidin-1-yl]acetamide has a molecular weight of 227.35 g/mol, XLogP of 0.71, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(pentan-3-ylamino)piperidin-1-yl]acetamide is sourced from PubChem (CID 43746855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).