N,N-di(propan-2-yl)-2-(4-pyrrolidin-2-ylpiperidin-1-yl)acetamide

C17H33N3O — CID 63259221

IUPACN,N-di(propan-2-yl)-2-(4-pyrrolidin-2-ylpiperidin-1-yl)acetamide
SMILESCC(C)N(C(=O)CN1CCC(C2CCCN2)CC1)C(C)C
InChIInChI=1S/C17H33N3O/c1-13(2)20(14(3)4)17(21)12-19-10-7-15(8-11-19)16-6-5-9-18-16/h13-16,18H,5-12H2,1-4H3
InChIKeyCTGHFNGBGWMYNS-UHFFFAOYSA-N
MW295.47 g/mol
LogP2.10
Rot. Bonds5

About N,N-di(propan-2-yl)-2-(4-pyrrolidin-2-ylpiperidin-1-yl)acetamide

N,N-di(propan-2-yl)-2-(4-pyrrolidin-2-ylpiperidin-1-yl)acetamide (PubChem CID 63259221) has the molecular formula C17H33N3O and a molecular weight of 295.47 g/mol. Its IUPAC name is N,N-di(propan-2-yl)-2-(4-pyrrolidin-2-ylpiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN,N-di(propan-2-yl)-2-(4-pyrrolidin-2-ylpiperidin-1-yl)acetamide
PubChem CID63259221
Molecular FormulaC17H33N3O
Molecular Weight295.47 g/mol
Exact Mass295.26
IUPAC NameN,N-di(propan-2-yl)-2-(4-pyrrolidin-2-ylpiperidin-1-yl)acetamide
SMILESCC(C)N(C(=O)CN1CCC(C2CCCN2)CC1)C(C)C
InChIInChI=1S/C17H33N3O/c1-13(2)20(14(3)4)17(21)12-19-10-7-15(8-11-19)16-6-5-9-18-16/h13-16,18H,5-12H2,1-4H3
InChIKeyCTGHFNGBGWMYNS-UHFFFAOYSA-N
XLogP2.10
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.47
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-propan-2-yl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)acetamide
CID 63259652
N-(methylcarbamoyl)-2-(4-pyrrolidin-2-ylpiperidin-1-yl)acetamide
CID 63259478
2-(1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl)-N,N-dimethylacetamide
CID 102682474
2-(4-aminopiperidin-1-yl)-N,N-di(propan-2-yl)acetamide
CID 43556875
2-methyl-1-(4-pyrrolidin-2-ylpiperidin-1-yl)propan-1-one
CID 63259596
N-butyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)acetamide
CID 63259352
2-(1,4-diazepan-1-yl)-N,N-di(propan-2-yl)acetamide;hydrochloride
CID 119906169
(4aR,8aR)-6-(3-methylbutyl)-2,3,4,4a,5,7,8,8a-octahydro-1H-1,6-naphthyridine
CID 118759759
2-(3-pyrrolidin-2-ylpiperidin-1-yl)acetic acid
CID 60978434
N,N-dimethyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)propanamide
CID 63259226
1-(2,3-dichloroprop-2-enyl)-4-pyrrolidin-2-ylpiperidine
CID 79172880
2-methyl-1-(4-pyrrolidin-2-ylpiperidin-1-yl)butan-1-one;hydrochloride
CID 119999275

Frequently Asked Questions

What is the IUPAC name of N,N-di(propan-2-yl)-2-(4-pyrrolidin-2-ylpiperidin-1-yl)acetamide?
The IUPAC name of N,N-di(propan-2-yl)-2-(4-pyrrolidin-2-ylpiperidin-1-yl)acetamide (CID 63259221) is N,N-di(propan-2-yl)-2-(4-pyrrolidin-2-ylpiperidin-1-yl)acetamide.
What is the SMILES notation for N,N-di(propan-2-yl)-2-(4-pyrrolidin-2-ylpiperidin-1-yl)acetamide?
The canonical SMILES for N,N-di(propan-2-yl)-2-(4-pyrrolidin-2-ylpiperidin-1-yl)acetamide is CC(C)N(C(=O)CN1CCC(C2CCCN2)CC1)C(C)C.
What is the InChIKey of N,N-di(propan-2-yl)-2-(4-pyrrolidin-2-ylpiperidin-1-yl)acetamide?
The InChIKey is CTGHFNGBGWMYNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33N3O/c1-13(2)20(14(3)4)17(21)12-19-10-7-15(8-11-19)16-6-5-9-18-16/h13-16,18H,5-12H2,1-4H3.
What are the key properties of N,N-di(propan-2-yl)-2-(4-pyrrolidin-2-ylpiperidin-1-yl)acetamide?
N,N-di(propan-2-yl)-2-(4-pyrrolidin-2-ylpiperidin-1-yl)acetamide has a molecular weight of 295.47 g/mol, XLogP of 2.10, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-di(propan-2-yl)-2-(4-pyrrolidin-2-ylpiperidin-1-yl)acetamide is sourced from PubChem (CID 63259221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).