N-(piperidin-3-ylmethyl)-N-propan-2-yl-3-pyrrolidin-1-ylpropanamide

C16H31N3O — CID 106628895

IUPACN-(piperidin-3-ylmethyl)-N-propan-2-yl-3-pyrrolidin-1-ylpropanamide
SMILESCC(C)N(CC1CCCNC1)C(=O)CCN1CCCC1
InChIInChI=1S/C16H31N3O/c1-14(2)19(13-15-6-5-8-17-12-15)16(20)7-11-18-9-3-4-10-18/h14-15,17H,3-13H2,1-2H3
InChIKeyLIVRQGKAZFDULQ-UHFFFAOYSA-N
MW281.44 g/mol
LogP1.71
Rot. Bonds6

About N-(piperidin-3-ylmethyl)-N-propan-2-yl-3-pyrrolidin-1-ylpropanamide

N-(piperidin-3-ylmethyl)-N-propan-2-yl-3-pyrrolidin-1-ylpropanamide (PubChem CID 106628895) has the molecular formula C16H31N3O and a molecular weight of 281.44 g/mol. Its IUPAC name is N-(piperidin-3-ylmethyl)-N-propan-2-yl-3-pyrrolidin-1-ylpropanamide.

Molecular Properties

Compound NameN-(piperidin-3-ylmethyl)-N-propan-2-yl-3-pyrrolidin-1-ylpropanamide
PubChem CID106628895
Molecular FormulaC16H31N3O
Molecular Weight281.44 g/mol
Exact Mass281.25
IUPAC NameN-(piperidin-3-ylmethyl)-N-propan-2-yl-3-pyrrolidin-1-ylpropanamide
SMILESCC(C)N(CC1CCCNC1)C(=O)CCN1CCCC1
InChIInChI=1S/C16H31N3O/c1-14(2)19(13-15-6-5-8-17-12-15)16(20)7-11-18-9-3-4-10-18/h14-15,17H,3-13H2,1-2H3
InChIKeyLIVRQGKAZFDULQ-UHFFFAOYSA-N
XLogP1.71
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.44
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(piperidin-3-ylmethyl)-N-propan-2-yl-3-pyrazol-1-ylpropanamide
CID 106629180
3-imidazol-1-yl-N-(piperidin-3-ylmethyl)-N-propan-2-ylpropanamide
CID 106629196
N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclobutanecarboxamide
CID 106629002
N-(piperidin-3-ylmethyl)-N-propan-2-yl-2-propan-2-yloxyacetamide
CID 106628870
1-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclopentane-1-carboxamide
CID 106629148
1-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclohexane-1-carboxamide
CID 106828147
2-(oxolan-2-yl)-N-(piperidin-3-ylmethyl)-N-propan-2-ylacetamide
CID 106629086
N-(piperidin-3-ylmethyl)-N-propan-2-yl-2-pyrazol-1-ylacetamide
CID 106629183
2-(2-hydroxyphenyl)-N-(piperidin-3-ylmethyl)-N-propan-2-ylacetamide
CID 106629125
1,5-dimethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyrrole-2-carboxamide
CID 106628957
2-(2-methylphenyl)-N-(piperidin-3-ylmethyl)-N-propan-2-ylacetamide
CID 106628910
2-(2-bicyclo[2.2.1]heptanyl)-N-(piperidin-3-ylmethyl)-N-propan-2-ylacetamide
CID 106628941

Frequently Asked Questions

What is the IUPAC name of N-(piperidin-3-ylmethyl)-N-propan-2-yl-3-pyrrolidin-1-ylpropanamide?
The IUPAC name of N-(piperidin-3-ylmethyl)-N-propan-2-yl-3-pyrrolidin-1-ylpropanamide (CID 106628895) is N-(piperidin-3-ylmethyl)-N-propan-2-yl-3-pyrrolidin-1-ylpropanamide.
What is the SMILES notation for N-(piperidin-3-ylmethyl)-N-propan-2-yl-3-pyrrolidin-1-ylpropanamide?
The canonical SMILES for N-(piperidin-3-ylmethyl)-N-propan-2-yl-3-pyrrolidin-1-ylpropanamide is CC(C)N(CC1CCCNC1)C(=O)CCN1CCCC1.
What is the InChIKey of N-(piperidin-3-ylmethyl)-N-propan-2-yl-3-pyrrolidin-1-ylpropanamide?
The InChIKey is LIVRQGKAZFDULQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3O/c1-14(2)19(13-15-6-5-8-17-12-15)16(20)7-11-18-9-3-4-10-18/h14-15,17H,3-13H2,1-2H3.
What are the key properties of N-(piperidin-3-ylmethyl)-N-propan-2-yl-3-pyrrolidin-1-ylpropanamide?
N-(piperidin-3-ylmethyl)-N-propan-2-yl-3-pyrrolidin-1-ylpropanamide has a molecular weight of 281.44 g/mol, XLogP of 1.71, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(piperidin-3-ylmethyl)-N-propan-2-yl-3-pyrrolidin-1-ylpropanamide is sourced from PubChem (CID 106628895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).