N-(2-amino-1-cyclopropylethyl)-N-methyl-3-pyrrolidin-1-ylpropanamide

C13H25N3O — CID 116651609

IUPACN-(2-amino-1-cyclopropylethyl)-N-methyl-3-pyrrolidin-1-ylpropanamide
SMILESCN(C(=O)CCN1CCCC1)C(CN)C1CC1
InChIInChI=1S/C13H25N3O/c1-15(12(10-14)11-4-5-11)13(17)6-9-16-7-2-3-8-16/h11-12H,2-10,14H2,1H3
InChIKeyZKIFUACOQMUXDN-UHFFFAOYSA-N
MW239.36 g/mol
LogP0.67
Rot. Bonds6

About N-(2-amino-1-cyclopropylethyl)-N-methyl-3-pyrrolidin-1-ylpropanamide

N-(2-amino-1-cyclopropylethyl)-N-methyl-3-pyrrolidin-1-ylpropanamide (PubChem CID 116651609) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is N-(2-amino-1-cyclopropylethyl)-N-methyl-3-pyrrolidin-1-ylpropanamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclopropylethyl)-N-methyl-3-pyrrolidin-1-ylpropanamide
PubChem CID116651609
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC NameN-(2-amino-1-cyclopropylethyl)-N-methyl-3-pyrrolidin-1-ylpropanamide
SMILESCN(C(=O)CCN1CCCC1)C(CN)C1CC1
InChIInChI=1S/C13H25N3O/c1-15(12(10-14)11-4-5-11)13(17)6-9-16-7-2-3-8-16/h11-12H,2-10,14H2,1H3
InChIKeyZKIFUACOQMUXDN-UHFFFAOYSA-N
XLogP0.67
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopropyl-N-methyl-N-(2-pyrrolidin-1-ylethyl)ethane-1,2-diamine
CID 63206854
N-(2-amino-1-cyclopropylethyl)-2-cyclopentyl-N-methylacetamide
CID 116651718
N-(2-amino-1-cyclopropylethyl)-3,3,3-trifluoro-N-methylpropanamide
CID 116651949
1-(2-amino-1-cyclopropylethyl)-1,3,3-trimethylurea
CID 116652099
N-(2-amino-1-cyclopropylethyl)-N,1-dimethylcyclopentane-1-carboxamide
CID 116651586
N-(2-amino-1-cyclopropylethyl)-N-methyl-3-(2-methylphenyl)propanamide
CID 116651728
N-(2-amino-1-cyclopropylethyl)-N-methyloxane-3-carboxamide
CID 116651608
N-(2-amino-1-cyclopropylethyl)-N-methylbicyclo[3.1.0]hexane-6-carboxamide
CID 116651597
N-(2-amino-1-cyclopropylethyl)-N,2-dimethylcyclopropane-1-carboxamide
CID 116651762
1-(2-amino-1-cyclopropylethyl)-3-cyclopropyl-1-methylurea
CID 116652105
N-(2-amino-1-cyclopropylethyl)-N,2-dimethylcyclopentane-1-carboxamide
CID 107181073
3-[3-(aminomethyl)piperidin-1-yl]-N,N-dimethylpropanamide
CID 60962395

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclopropylethyl)-N-methyl-3-pyrrolidin-1-ylpropanamide?
The IUPAC name of N-(2-amino-1-cyclopropylethyl)-N-methyl-3-pyrrolidin-1-ylpropanamide (CID 116651609) is N-(2-amino-1-cyclopropylethyl)-N-methyl-3-pyrrolidin-1-ylpropanamide.
What is the SMILES notation for N-(2-amino-1-cyclopropylethyl)-N-methyl-3-pyrrolidin-1-ylpropanamide?
The canonical SMILES for N-(2-amino-1-cyclopropylethyl)-N-methyl-3-pyrrolidin-1-ylpropanamide is CN(C(=O)CCN1CCCC1)C(CN)C1CC1.
What is the InChIKey of N-(2-amino-1-cyclopropylethyl)-N-methyl-3-pyrrolidin-1-ylpropanamide?
The InChIKey is ZKIFUACOQMUXDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c1-15(12(10-14)11-4-5-11)13(17)6-9-16-7-2-3-8-16/h11-12H,2-10,14H2,1H3.
What are the key properties of N-(2-amino-1-cyclopropylethyl)-N-methyl-3-pyrrolidin-1-ylpropanamide?
N-(2-amino-1-cyclopropylethyl)-N-methyl-3-pyrrolidin-1-ylpropanamide has a molecular weight of 239.36 g/mol, XLogP of 0.67, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclopropylethyl)-N-methyl-3-pyrrolidin-1-ylpropanamide is sourced from PubChem (CID 116651609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).