1-amino-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]cyclopentane-1-carboxamide

C15H23N5O3 — CID 119333469

IUPAC1-amino-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]cyclopentane-1-carboxamide
SMILESNC1(C(=O)Nc2cnn(CC(=O)N3CCOCC3)c2)CCCC1
InChIInChI=1S/C15H23N5O3/c16-15(3-1-2-4-15)14(22)18-12-9-17-20(10-12)11-13(21)19-5-7-23-8-6-19/h9-10H,1-8,11,16H2,(H,18,22)
InChIKeyQKITVLMBTNJKOE-UHFFFAOYSA-N
MW321.38 g/mol
LogP-0.05
Rot. Bonds4

About 1-amino-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]cyclopentane-1-carboxamide

1-amino-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]cyclopentane-1-carboxamide (PubChem CID 119333469) has the molecular formula C15H23N5O3 and a molecular weight of 321.38 g/mol. Its IUPAC name is 1-amino-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]cyclopentane-1-carboxamide
PubChem CID119333469
Molecular FormulaC15H23N5O3
Molecular Weight321.38 g/mol
Exact Mass321.18
IUPAC Name1-amino-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]cyclopentane-1-carboxamide
SMILESNC1(C(=O)Nc2cnn(CC(=O)N3CCOCC3)c2)CCCC1
InChIInChI=1S/C15H23N5O3/c16-15(3-1-2-4-15)14(22)18-12-9-17-20(10-12)11-13(21)19-5-7-23-8-6-19/h9-10H,1-8,11,16H2,(H,18,22)
InChIKeyQKITVLMBTNJKOE-UHFFFAOYSA-N
XLogP-0.05
TPSA102.48 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 5-0.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]cyclopentane-1-carboxamide (CID 119333469) is 1-amino-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]cyclopentane-1-carboxamide is NC1(C(=O)Nc2cnn(CC(=O)N3CCOCC3)c2)CCCC1.
What is the InChIKey of 1-amino-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]cyclopentane-1-carboxamide?
The InChIKey is QKITVLMBTNJKOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O3/c16-15(3-1-2-4-15)14(22)18-12-9-17-20(10-12)11-13(21)19-5-7-23-8-6-19/h9-10H,1-8,11,16H2,(H,18,22).
What are the key properties of 1-amino-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]cyclopentane-1-carboxamide?
1-amino-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]cyclopentane-1-carboxamide has a molecular weight of 321.38 g/mol, XLogP of -0.05, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]cyclopentane-1-carboxamide is sourced from PubChem (CID 119333469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).