1-(ethylamino)-2,3,5,6,7,8-hexahydropyrrolizine-1-carboxamide

C10H19N3O — CID 82853255

IUPAC1-(ethylamino)-2,3,5,6,7,8-hexahydropyrrolizine-1-carboxamide
SMILESCCNC1(C(N)=O)CCN2CCCC21
InChIInChI=1S/C10H19N3O/c1-2-12-10(9(11)14)5-7-13-6-3-4-8(10)13/h8,12H,2-7H2,1H3,(H2,11,14)
InChIKeyURJUOPBZYVQEFH-UHFFFAOYSA-N
MW197.28 g/mol
LogP-0.31
Rot. Bonds3

About 1-(ethylamino)-2,3,5,6,7,8-hexahydropyrrolizine-1-carboxamide

1-(ethylamino)-2,3,5,6,7,8-hexahydropyrrolizine-1-carboxamide (PubChem CID 82853255) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is 1-(ethylamino)-2,3,5,6,7,8-hexahydropyrrolizine-1-carboxamide.

Molecular Properties

Compound Name1-(ethylamino)-2,3,5,6,7,8-hexahydropyrrolizine-1-carboxamide
PubChem CID82853255
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name1-(ethylamino)-2,3,5,6,7,8-hexahydropyrrolizine-1-carboxamide
SMILESCCNC1(C(N)=O)CCN2CCCC21
InChIInChI=1S/C10H19N3O/c1-2-12-10(9(11)14)5-7-13-6-3-4-8(10)13/h8,12H,2-7H2,1H3,(H2,11,14)
InChIKeyURJUOPBZYVQEFH-UHFFFAOYSA-N
XLogP-0.31
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 5-0.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(ethylamino)-2,3,5,6,7,8-hexahydropyrrolizine-1-carboxamide?
The IUPAC name of 1-(ethylamino)-2,3,5,6,7,8-hexahydropyrrolizine-1-carboxamide (CID 82853255) is 1-(ethylamino)-2,3,5,6,7,8-hexahydropyrrolizine-1-carboxamide.
What is the SMILES notation for 1-(ethylamino)-2,3,5,6,7,8-hexahydropyrrolizine-1-carboxamide?
The canonical SMILES for 1-(ethylamino)-2,3,5,6,7,8-hexahydropyrrolizine-1-carboxamide is CCNC1(C(N)=O)CCN2CCCC21.
What is the InChIKey of 1-(ethylamino)-2,3,5,6,7,8-hexahydropyrrolizine-1-carboxamide?
The InChIKey is URJUOPBZYVQEFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O/c1-2-12-10(9(11)14)5-7-13-6-3-4-8(10)13/h8,12H,2-7H2,1H3,(H2,11,14).
What are the key properties of 1-(ethylamino)-2,3,5,6,7,8-hexahydropyrrolizine-1-carboxamide?
1-(ethylamino)-2,3,5,6,7,8-hexahydropyrrolizine-1-carboxamide has a molecular weight of 197.28 g/mol, XLogP of -0.31, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(ethylamino)-2,3,5,6,7,8-hexahydropyrrolizine-1-carboxamide is sourced from PubChem (CID 82853255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).