(2R)-2-amino-3,3-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)butanamide

C15H31N3O — CID 103929423

IUPAC(2R)-2-amino-3,3-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)butanamide
SMILESCC(CNC(=O)[C@H](N)C(C)(C)C)CN1CCCCC1
InChIInChI=1S/C15H31N3O/c1-12(11-18-8-6-5-7-9-18)10-17-14(19)13(16)15(2,3)4/h12-13H,5-11,16H2,1-4H3,(H,17,19)/t12?,13-/m0/s1
InChIKeyNUKPMZBBCDHPHU-ABLWVSNPSA-N
MW269.43 g/mol
LogP1.60
Rot. Bonds5

About (2R)-2-amino-3,3-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)butanamide

(2R)-2-amino-3,3-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)butanamide (PubChem CID 103929423) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is (2R)-2-amino-3,3-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)butanamide.

Molecular Properties

Compound Name(2R)-2-amino-3,3-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)butanamide
PubChem CID103929423
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC Name(2R)-2-amino-3,3-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)butanamide
SMILESCC(CNC(=O)[C@H](N)C(C)(C)C)CN1CCCCC1
InChIInChI=1S/C15H31N3O/c1-12(11-18-8-6-5-7-9-18)10-17-14(19)13(16)15(2,3)4/h12-13H,5-11,16H2,1-4H3,(H,17,19)/t12?,13-/m0/s1
InChIKeyNUKPMZBBCDHPHU-ABLWVSNPSA-N
XLogP1.60
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-3-methyl-N-(2-methyl-3-piperidin-1-ylpropyl)butanamide
CID 54906618
2-amino-3,3-dimethyl-N-(1-piperidin-1-ylpropan-2-yl)butanamide
CID 76893128
(2R)-2-amino-3,3-dimethyl-N-(2-piperidin-1-ylpropyl)butanamide
CID 113353389
2-amino-4-methyl-N-(2-methyl-3-piperidin-1-ylpropyl)pentanamide
CID 54906759
3-amino-4-[(2-methyl-3-piperidin-1-ylpropyl)amino]-4-oxobutanoic acid
CID 64897097
2-amino-2-methyl-N-(2-methyl-3-piperidin-1-ylpropyl)propanamide;dihydrochloride
CID 119859839
2-chloro-N-(2-methyl-3-pyrrolidin-1-ylpropyl)propanamide
CID 62992796
(2R)-2-amino-3,3-dimethyl-N-(3-piperidin-1-ylpropyl)butanamide
CID 103928449
2-amino-N-(2-methyl-3-pyrrolidin-1-ylpropyl)acetamide
CID 62060304
4-amino-5-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]-5-oxopentanoic acid
CID 64890132
N-(2-methyl-3-pyrrolidin-1-ylpropyl)acetamide
CID 61062993
2-bromo-2-methyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)propanamide
CID 114328650

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-3,3-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)butanamide?
The IUPAC name of (2R)-2-amino-3,3-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)butanamide (CID 103929423) is (2R)-2-amino-3,3-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)butanamide.
What is the SMILES notation for (2R)-2-amino-3,3-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)butanamide?
The canonical SMILES for (2R)-2-amino-3,3-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)butanamide is CC(CNC(=O)[C@H](N)C(C)(C)C)CN1CCCCC1.
What is the InChIKey of (2R)-2-amino-3,3-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)butanamide?
The InChIKey is NUKPMZBBCDHPHU-ABLWVSNPSA-N. The full InChI is InChI=1S/C15H31N3O/c1-12(11-18-8-6-5-7-9-18)10-17-14(19)13(16)15(2,3)4/h12-13H,5-11,16H2,1-4H3,(H,17,19)/t12?,13-/m0/s1.
What are the key properties of (2R)-2-amino-3,3-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)butanamide?
(2R)-2-amino-3,3-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)butanamide has a molecular weight of 269.43 g/mol, XLogP of 1.60, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-3,3-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)butanamide is sourced from PubChem (CID 103929423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).