N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinazoline-4-carboxamide

C18H26N6O2 — CID 25283044

IUPACN-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinazoline-4-carboxamide
SMILESO=C(NCCN1CCNC1=O)c1nc(N2CCCC2)nc2c1CCCC2
InChIInChI=1S/C18H26N6O2/c25-16(19-7-11-24-12-8-20-18(24)26)15-13-5-1-2-6-14(13)21-17(22-15)23-9-3-4-10-23/h1-12H2,(H,19,25)(H,20,26)
InChIKeyTWYHZAHWMLOCSL-UHFFFAOYSA-N
MW358.45 g/mol
LogP0.71
Rot. Bonds5

About N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinazoline-4-carboxamide

N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinazoline-4-carboxamide (PubChem CID 25283044) has the molecular formula C18H26N6O2 and a molecular weight of 358.45 g/mol. Its IUPAC name is N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinazoline-4-carboxamide.

Molecular Properties

Compound NameN-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinazoline-4-carboxamide
PubChem CID25283044
Molecular FormulaC18H26N6O2
Molecular Weight358.45 g/mol
Exact Mass358.21
IUPAC NameN-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinazoline-4-carboxamide
SMILESO=C(NCCN1CCNC1=O)c1nc(N2CCCC2)nc2c1CCCC2
InChIInChI=1S/C18H26N6O2/c25-16(19-7-11-24-12-8-20-18(24)26)15-13-5-1-2-6-14(13)21-17(22-15)23-9-3-4-10-23/h1-12H2,(H,19,25)(H,20,26)
InChIKeyTWYHZAHWMLOCSL-UHFFFAOYSA-N
XLogP0.71
TPSA90.46 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.45
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinazoline-4-carboxamide?
The IUPAC name of N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinazoline-4-carboxamide (CID 25283044) is N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinazoline-4-carboxamide.
What is the SMILES notation for N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinazoline-4-carboxamide?
The canonical SMILES for N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinazoline-4-carboxamide is O=C(NCCN1CCNC1=O)c1nc(N2CCCC2)nc2c1CCCC2.
What is the InChIKey of N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinazoline-4-carboxamide?
The InChIKey is TWYHZAHWMLOCSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N6O2/c25-16(19-7-11-24-12-8-20-18(24)26)15-13-5-1-2-6-14(13)21-17(22-15)23-9-3-4-10-23/h1-12H2,(H,19,25)(H,20,26).
What are the key properties of N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinazoline-4-carboxamide?
N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinazoline-4-carboxamide has a molecular weight of 358.45 g/mol, XLogP of 0.71, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinazoline-4-carboxamide is sourced from PubChem (CID 25283044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).