1-methyl-N-(piperidin-2-ylmethyl)-N-propylpyrrolidine-3-carboxamide

C15H29N3O — CID 106625670

IUPAC1-methyl-N-(piperidin-2-ylmethyl)-N-propylpyrrolidine-3-carboxamide
SMILESCCCN(CC1CCCCN1)C(=O)C1CCN(C)C1
InChIInChI=1S/C15H29N3O/c1-3-9-18(12-14-6-4-5-8-16-14)15(19)13-7-10-17(2)11-13/h13-14,16H,3-12H2,1-2H3
InChIKeyMYDKBDHSGQXNOB-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.32
Rot. Bonds5

About 1-methyl-N-(piperidin-2-ylmethyl)-N-propylpyrrolidine-3-carboxamide

1-methyl-N-(piperidin-2-ylmethyl)-N-propylpyrrolidine-3-carboxamide (PubChem CID 106625670) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 1-methyl-N-(piperidin-2-ylmethyl)-N-propylpyrrolidine-3-carboxamide.

Molecular Properties

Compound Name1-methyl-N-(piperidin-2-ylmethyl)-N-propylpyrrolidine-3-carboxamide
PubChem CID106625670
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name1-methyl-N-(piperidin-2-ylmethyl)-N-propylpyrrolidine-3-carboxamide
SMILESCCCN(CC1CCCCN1)C(=O)C1CCN(C)C1
InChIInChI=1S/C15H29N3O/c1-3-9-18(12-14-6-4-5-8-16-14)15(19)13-7-10-17(2)11-13/h13-14,16H,3-12H2,1-2H3
InChIKeyMYDKBDHSGQXNOB-UHFFFAOYSA-N
XLogP1.32
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(piperidin-2-ylmethyl)-N-propylcyclooctanecarboxamide
CID 106625676
1-methyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)pyrrolidine-3-carboxamide
CID 106611146
N-(piperidin-2-ylmethyl)-N-propylbicyclo[3.1.0]hexane-3-carboxamide
CID 106625572
N-propyl-N-(pyrrolidin-2-ylmethyl)cyclobutanecarboxamide
CID 106610516
2,2-difluoro-N-(piperidin-2-ylmethyl)-N-propylacetamide
CID 106625526
2-cycloheptyl-N-(piperidin-2-ylmethyl)-N-propylacetamide
CID 106625612
4-methyl-N-(piperidin-2-ylmethyl)-N-propylpiperidine-1-carboxamide
CID 106629827
2,4,5-trimethyl-N-(piperidin-2-ylmethyl)-N-propyloxolane-3-carboxamide
CID 106625536
N-propyl-N-(pyrrolidin-2-ylmethyl)acetamide
CID 106610345
N-propyl-N-(pyrrolidin-2-ylmethyl)propanamide
CID 106610515
5-methyl-N-propyl-N-(pyrrolidin-2-ylmethyl)oxolane-2-carboxamide
CID 106610382
N,2-dipropyl-N-(pyrrolidin-2-ylmethyl)pentanamide
CID 106610385

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(piperidin-2-ylmethyl)-N-propylpyrrolidine-3-carboxamide?
The IUPAC name of 1-methyl-N-(piperidin-2-ylmethyl)-N-propylpyrrolidine-3-carboxamide (CID 106625670) is 1-methyl-N-(piperidin-2-ylmethyl)-N-propylpyrrolidine-3-carboxamide.
What is the SMILES notation for 1-methyl-N-(piperidin-2-ylmethyl)-N-propylpyrrolidine-3-carboxamide?
The canonical SMILES for 1-methyl-N-(piperidin-2-ylmethyl)-N-propylpyrrolidine-3-carboxamide is CCCN(CC1CCCCN1)C(=O)C1CCN(C)C1.
What is the InChIKey of 1-methyl-N-(piperidin-2-ylmethyl)-N-propylpyrrolidine-3-carboxamide?
The InChIKey is MYDKBDHSGQXNOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-3-9-18(12-14-6-4-5-8-16-14)15(19)13-7-10-17(2)11-13/h13-14,16H,3-12H2,1-2H3.
What are the key properties of 1-methyl-N-(piperidin-2-ylmethyl)-N-propylpyrrolidine-3-carboxamide?
1-methyl-N-(piperidin-2-ylmethyl)-N-propylpyrrolidine-3-carboxamide has a molecular weight of 267.42 g/mol, XLogP of 1.32, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(piperidin-2-ylmethyl)-N-propylpyrrolidine-3-carboxamide is sourced from PubChem (CID 106625670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).