N-[(3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-3-pyrrolidin-1-ylpropanamide

C15H29N3O — CID 130375889

IUPACN-[(3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-3-pyrrolidin-1-ylpropanamide
SMILESCC(C)N1C[C@@H](C)[C@H](NC(=O)CCN2CCCC2)C1
InChIInChI=1S/C15H29N3O/c1-12(2)18-10-13(3)14(11-18)16-15(19)6-9-17-7-4-5-8-17/h12-14H,4-11H2,1-3H3,(H,16,19)/t13-,14-/m1/s1
InChIKeyLAHFBVPFGGCPLK-ZIAGYGMSSA-N
MW267.42 g/mol
LogP1.32
Rot. Bonds5

About N-[(3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-3-pyrrolidin-1-ylpropanamide

N-[(3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-3-pyrrolidin-1-ylpropanamide (PubChem CID 130375889) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is N-[(3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-3-pyrrolidin-1-ylpropanamide.

Molecular Properties

Compound NameN-[(3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-3-pyrrolidin-1-ylpropanamide
PubChem CID130375889
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC NameN-[(3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-3-pyrrolidin-1-ylpropanamide
SMILESCC(C)N1C[C@@H](C)[C@H](NC(=O)CCN2CCCC2)C1
InChIInChI=1S/C15H29N3O/c1-12(2)18-10-13(3)14(11-18)16-15(19)6-9-17-7-4-5-8-17/h12-14H,4-11H2,1-3H3,(H,16,19)/t13-,14-/m1/s1
InChIKeyLAHFBVPFGGCPLK-ZIAGYGMSSA-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-(3-methylbutyl)-3-pyrrolidin-1-ylpropanamide
CID 110688182
N-(1-methylpiperidin-3-yl)-3-pyrrolidin-1-ylpropanamide
CID 121458775
N-(2-methylcyclohexyl)-3-piperazin-1-ylpropanamide
CID 66990087
3-(azepan-1-yl)-N-cyclohexylpropanamide
CID 109014005
N-cycloheptyl-3-pyrrolidin-1-ylpropanamide
CID 110688180
N-cyclohexyl-3-pyrrolidin-1-ylpropanamide
CID 71029146
N-methyl-3-pyrrolidin-1-ylpropanamide
CID 20700879
3-[3-methyl-4-(methylamino)piperidin-1-yl]-N-propan-2-ylpropanamide
CID 114499150
N,4-dimethyl-2-[(4-methyl-1-propan-2-ylpyrrolidin-3-yl)amino]pentanamide
CID 75427797
3-propan-2-yl-N-(3-pyrrolidin-1-ylpropyl)-3-azabicyclo[3.3.1]nonan-9-amine
CID 61240803
N'-butan-2-yl-3-piperidin-1-ylpropanehydrazide
CID 4143849
N-(5-hydroxy-4-methylpentyl)-3-pyrrolidin-1-ylpropanamide
CID 113340869

Frequently Asked Questions

What is the IUPAC name of N-[(3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-3-pyrrolidin-1-ylpropanamide?
The IUPAC name of N-[(3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-3-pyrrolidin-1-ylpropanamide (CID 130375889) is N-[(3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-3-pyrrolidin-1-ylpropanamide.
What is the SMILES notation for N-[(3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-3-pyrrolidin-1-ylpropanamide?
The canonical SMILES for N-[(3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-3-pyrrolidin-1-ylpropanamide is CC(C)N1C[C@@H](C)[C@H](NC(=O)CCN2CCCC2)C1.
What is the InChIKey of N-[(3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-3-pyrrolidin-1-ylpropanamide?
The InChIKey is LAHFBVPFGGCPLK-ZIAGYGMSSA-N. The full InChI is InChI=1S/C15H29N3O/c1-12(2)18-10-13(3)14(11-18)16-15(19)6-9-17-7-4-5-8-17/h12-14H,4-11H2,1-3H3,(H,16,19)/t13-,14-/m1/s1.
What are the key properties of N-[(3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-3-pyrrolidin-1-ylpropanamide?
N-[(3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-3-pyrrolidin-1-ylpropanamide 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 N-[(3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-3-pyrrolidin-1-ylpropanamide is sourced from PubChem (CID 130375889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).