N-(cyclopropylmethyl)-N,3-dipropylpyrrolidine-3-carboxamide

C15H28N2O — CID 63138996

IUPACN-(cyclopropylmethyl)-N,3-dipropylpyrrolidine-3-carboxamide
SMILESCCCN(CC1CC1)C(=O)C1(CCC)CCNC1
InChIInChI=1S/C15H28N2O/c1-3-7-15(8-9-16-12-15)14(18)17(10-4-2)11-13-5-6-13/h13,16H,3-12H2,1-2H3
InChIKeySOROFGCSZNIFRB-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.41
Rot. Bonds7

About N-(cyclopropylmethyl)-N,3-dipropylpyrrolidine-3-carboxamide

N-(cyclopropylmethyl)-N,3-dipropylpyrrolidine-3-carboxamide (PubChem CID 63138996) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-N,3-dipropylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-N,3-dipropylpyrrolidine-3-carboxamide
PubChem CID63138996
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC NameN-(cyclopropylmethyl)-N,3-dipropylpyrrolidine-3-carboxamide
SMILESCCCN(CC1CC1)C(=O)C1(CCC)CCNC1
InChIInChI=1S/C15H28N2O/c1-3-7-15(8-9-16-12-15)14(18)17(10-4-2)11-13-5-6-13/h13,16H,3-12H2,1-2H3
InChIKeySOROFGCSZNIFRB-UHFFFAOYSA-N
XLogP2.41
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-N,3-dipropylpyrrolidine-3-carboxamide?
The IUPAC name of N-(cyclopropylmethyl)-N,3-dipropylpyrrolidine-3-carboxamide (CID 63138996) is N-(cyclopropylmethyl)-N,3-dipropylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-(cyclopropylmethyl)-N,3-dipropylpyrrolidine-3-carboxamide?
The canonical SMILES for N-(cyclopropylmethyl)-N,3-dipropylpyrrolidine-3-carboxamide is CCCN(CC1CC1)C(=O)C1(CCC)CCNC1.
What is the InChIKey of N-(cyclopropylmethyl)-N,3-dipropylpyrrolidine-3-carboxamide?
The InChIKey is SOROFGCSZNIFRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-3-7-15(8-9-16-12-15)14(18)17(10-4-2)11-13-5-6-13/h13,16H,3-12H2,1-2H3.
What are the key properties of N-(cyclopropylmethyl)-N,3-dipropylpyrrolidine-3-carboxamide?
N-(cyclopropylmethyl)-N,3-dipropylpyrrolidine-3-carboxamide has a molecular weight of 252.40 g/mol, XLogP of 2.41, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-N,3-dipropylpyrrolidine-3-carboxamide is sourced from PubChem (CID 63138996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).