2-amino-2-methyl-4-(4-propylpiperidin-1-yl)butanamide

C13H27N3O — CID 62205252

IUPAC2-amino-2-methyl-4-(4-propylpiperidin-1-yl)butanamide
SMILESCCCC1CCN(CCC(C)(N)C(N)=O)CC1
InChIInChI=1S/C13H27N3O/c1-3-4-11-5-8-16(9-6-11)10-7-13(2,15)12(14)17/h11H,3-10,15H2,1-2H3,(H2,14,17)
InChIKeySKEKVGFBRMTBAO-UHFFFAOYSA-N
MW241.38 g/mol
LogP1.09
Rot. Bonds6

About 2-amino-2-methyl-4-(4-propylpiperidin-1-yl)butanamide

2-amino-2-methyl-4-(4-propylpiperidin-1-yl)butanamide (PubChem CID 62205252) has the molecular formula C13H27N3O and a molecular weight of 241.38 g/mol. Its IUPAC name is 2-amino-2-methyl-4-(4-propylpiperidin-1-yl)butanamide.

Molecular Properties

Compound Name2-amino-2-methyl-4-(4-propylpiperidin-1-yl)butanamide
PubChem CID62205252
Molecular FormulaC13H27N3O
Molecular Weight241.38 g/mol
Exact Mass241.22
IUPAC Name2-amino-2-methyl-4-(4-propylpiperidin-1-yl)butanamide
SMILESCCCC1CCN(CCC(C)(N)C(N)=O)CC1
InChIInChI=1S/C13H27N3O/c1-3-4-11-5-8-16(9-6-11)10-7-13(2,15)12(14)17/h11H,3-10,15H2,1-2H3,(H2,14,17)
InChIKeySKEKVGFBRMTBAO-UHFFFAOYSA-N
XLogP1.09
TPSA72.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-2-methyl-5-(4-propylpiperidin-1-yl)pentanoic acid
CID 62206652
2-amino-2-methyl-6-(4-propylpiperidin-1-yl)hexanoic acid
CID 62206651
2-amino-4-(3-methoxypyrrolidin-1-yl)-2-methylbutanamide
CID 103538003
methyl 2-amino-4-[4-(methoxymethyl)piperidin-1-yl]-2-methylbutanoate
CID 63971410
2-amino-2-methyl-4-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]butanamide
CID 62968267
1-[2-(4-propylpiperidin-1-yl)ethyl]piperidin-4-amine
CID 79327456
2-(ethylamino)-2-methyl-3-(4-propylpiperidin-1-yl)propanamide
CID 62204355
2-methyl-2-(propan-2-ylamino)-4-(4-propylpiperidin-1-yl)butanoic acid
CID 62205065
2-methyl-1-(4-propylpiperidin-1-yl)pentan-2-amine
CID 62204904
2-amino-4-[3-(methoxymethyl)pyrrolidin-1-yl]-2-methylbutanoic acid
CID 64581345
3,3-dimethyl-1-(4-propylpiperidin-1-yl)butan-2-one
CID 62205767
2-amino-2-ethyl-5-(4-propylazepan-1-yl)pentanoic acid
CID 106806311

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-methyl-4-(4-propylpiperidin-1-yl)butanamide?
The IUPAC name of 2-amino-2-methyl-4-(4-propylpiperidin-1-yl)butanamide (CID 62205252) is 2-amino-2-methyl-4-(4-propylpiperidin-1-yl)butanamide.
What is the SMILES notation for 2-amino-2-methyl-4-(4-propylpiperidin-1-yl)butanamide?
The canonical SMILES for 2-amino-2-methyl-4-(4-propylpiperidin-1-yl)butanamide is CCCC1CCN(CCC(C)(N)C(N)=O)CC1.
What is the InChIKey of 2-amino-2-methyl-4-(4-propylpiperidin-1-yl)butanamide?
The InChIKey is SKEKVGFBRMTBAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O/c1-3-4-11-5-8-16(9-6-11)10-7-13(2,15)12(14)17/h11H,3-10,15H2,1-2H3,(H2,14,17).
What are the key properties of 2-amino-2-methyl-4-(4-propylpiperidin-1-yl)butanamide?
2-amino-2-methyl-4-(4-propylpiperidin-1-yl)butanamide has a molecular weight of 241.38 g/mol, XLogP of 1.09, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-methyl-4-(4-propylpiperidin-1-yl)butanamide is sourced from PubChem (CID 62205252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).