N-(2-methylpropyl)-2-[(2R)-2-(pyrrolidine-1-carbonyl)piperidin-1-yl]acetamide

C16H29N3O2 — CID 94778620

IUPACN-(2-methylpropyl)-2-[(2R)-2-(pyrrolidine-1-carbonyl)piperidin-1-yl]acetamide
SMILESCC(C)CNC(=O)CN1CCCC[C@@H]1C(=O)N1CCCC1
InChIInChI=1S/C16H29N3O2/c1-13(2)11-17-15(20)12-19-10-4-3-7-14(19)16(21)18-8-5-6-9-18/h13-14H,3-12H2,1-2H3,(H,17,20)/t14-/m1/s1
InChIKeyPHGPPFAEFMTPEN-CQSZACIVSA-N
MW295.43 g/mol
LogP1.24
Rot. Bonds5

About N-(2-methylpropyl)-2-[(2R)-2-(pyrrolidine-1-carbonyl)piperidin-1-yl]acetamide

N-(2-methylpropyl)-2-[(2R)-2-(pyrrolidine-1-carbonyl)piperidin-1-yl]acetamide (PubChem CID 94778620) has the molecular formula C16H29N3O2 and a molecular weight of 295.43 g/mol. Its IUPAC name is N-(2-methylpropyl)-2-[(2R)-2-(pyrrolidine-1-carbonyl)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-2-[(2R)-2-(pyrrolidine-1-carbonyl)piperidin-1-yl]acetamide
PubChem CID94778620
Molecular FormulaC16H29N3O2
Molecular Weight295.43 g/mol
Exact Mass295.23
IUPAC NameN-(2-methylpropyl)-2-[(2R)-2-(pyrrolidine-1-carbonyl)piperidin-1-yl]acetamide
SMILESCC(C)CNC(=O)CN1CCCC[C@@H]1C(=O)N1CCCC1
InChIInChI=1S/C16H29N3O2/c1-13(2)11-17-15(20)12-19-10-4-3-7-14(19)16(21)18-8-5-6-9-18/h13-14H,3-12H2,1-2H3,(H,17,20)/t14-/m1/s1
InChIKeyPHGPPFAEFMTPEN-CQSZACIVSA-N
XLogP1.24
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methylpropyl)-2-[2-(piperazine-1-carbonyl)pyrrolidin-1-yl]acetamide
CID 61175724
N-(ethylcarbamoyl)-2-[2-(pyrrolidine-1-carbonyl)piperidin-1-yl]acetamide
CID 51098388
N-(2-methylpropyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide
CID 78788315
2-[(2S)-1-[2-(2-methylpropylamino)-2-oxoethyl]piperidin-2-yl]acetic acid
CID 93438414
methyl 2-[1-[2-(2-methylpropylamino)-2-oxoethyl]piperidin-2-yl]acetate
CID 61360608
N-(2-methylpropyl)-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]acetamide
CID 63854873
N-(2-methylpropyl)-2-[(2R)-2-(1-methylpyrazol-4-yl)pyrrolidin-1-yl]acetamide
CID 95346557
N-(3-acetylphenyl)-2-[(2S)-2-(pyrrolidine-1-carbonyl)piperidin-1-yl]acetamide
CID 52518463
N-cyclopropyl-2-[2-(morpholine-4-carbonyl)pyrrolidin-1-yl]acetamide
CID 47075935
2-[(2S)-2-(1,3-benzothiazol-2-yl)piperidin-1-yl]-N-(2-methylpropyl)acetamide
CID 9135401
(1-ethylpiperidin-2-yl)-morpholin-4-ylmethanone
CID 142202703
1-[2-oxo-2-(propylamino)ethyl]azepane-2-carboxylic acid
CID 64564538

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-2-[(2R)-2-(pyrrolidine-1-carbonyl)piperidin-1-yl]acetamide?
The IUPAC name of N-(2-methylpropyl)-2-[(2R)-2-(pyrrolidine-1-carbonyl)piperidin-1-yl]acetamide (CID 94778620) is N-(2-methylpropyl)-2-[(2R)-2-(pyrrolidine-1-carbonyl)piperidin-1-yl]acetamide.
What is the SMILES notation for N-(2-methylpropyl)-2-[(2R)-2-(pyrrolidine-1-carbonyl)piperidin-1-yl]acetamide?
The canonical SMILES for N-(2-methylpropyl)-2-[(2R)-2-(pyrrolidine-1-carbonyl)piperidin-1-yl]acetamide is CC(C)CNC(=O)CN1CCCC[C@@H]1C(=O)N1CCCC1.
What is the InChIKey of N-(2-methylpropyl)-2-[(2R)-2-(pyrrolidine-1-carbonyl)piperidin-1-yl]acetamide?
The InChIKey is PHGPPFAEFMTPEN-CQSZACIVSA-N. The full InChI is InChI=1S/C16H29N3O2/c1-13(2)11-17-15(20)12-19-10-4-3-7-14(19)16(21)18-8-5-6-9-18/h13-14H,3-12H2,1-2H3,(H,17,20)/t14-/m1/s1.
What are the key properties of N-(2-methylpropyl)-2-[(2R)-2-(pyrrolidine-1-carbonyl)piperidin-1-yl]acetamide?
N-(2-methylpropyl)-2-[(2R)-2-(pyrrolidine-1-carbonyl)piperidin-1-yl]acetamide has a molecular weight of 295.43 g/mol, XLogP of 1.24, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-2-[(2R)-2-(pyrrolidine-1-carbonyl)piperidin-1-yl]acetamide is sourced from PubChem (CID 94778620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).