2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide

C13H21N5O2 — CID 106599752

IUPAC2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
SMILESCc1nnc(NC(=O)CN(CC2CCCN2)C2CC2)o1
InChIInChI=1S/C13H21N5O2/c1-9-16-17-13(20-9)15-12(19)8-18(11-4-5-11)7-10-3-2-6-14-10/h10-11,14H,2-8H2,1H3,(H,15,17,19)
InChIKeyULKGCXYBZIEQIT-UHFFFAOYSA-N
MW279.34 g/mol
LogP0.53
Rot. Bonds6

About 2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide

2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide (PubChem CID 106599752) has the molecular formula C13H21N5O2 and a molecular weight of 279.34 g/mol. Its IUPAC name is 2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
PubChem CID106599752
Molecular FormulaC13H21N5O2
Molecular Weight279.34 g/mol
Exact Mass279.17
IUPAC Name2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
SMILESCc1nnc(NC(=O)CN(CC2CCCN2)C2CC2)o1
InChIInChI=1S/C13H21N5O2/c1-9-16-17-13(20-9)15-12(19)8-18(11-4-5-11)7-10-3-2-6-14-10/h10-11,14H,2-8H2,1H3,(H,15,17,19)
InChIKeyULKGCXYBZIEQIT-UHFFFAOYSA-N
XLogP0.53
TPSA83.29 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-[cyclopropylmethyl(pyrrolidin-2-ylmethyl)amino]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
CID 106616264
N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-[2-methylpropyl(pyrrolidin-2-ylmethyl)amino]acetamide
CID 106617114
N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-[piperidin-2-ylmethyl(propan-2-yl)amino]acetamide
CID 106631945
N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-[piperidin-2-ylmethyl(propyl)amino]acetamide
CID 106635893
N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-[methyl(pyrrolidin-2-ylmethyl)amino]acetamide
CID 106613532
N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-[methyl(piperidin-2-ylmethyl)amino]acetamide
CID 106635133
N-(4-bromophenyl)-2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]acetamide
CID 103519927
N-(2-chlorophenyl)-2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]acetamide
CID 104979253
2-[cyclopropyl(piperidin-2-ylmethyl)amino]-N-(ethylcarbamoyl)acetamide
CID 106631667
(2R)-N-(5-methyl-1,3,4-oxadiazol-2-yl)piperidine-2-carboxamide
CID 104914813
2-[cyclopropyl-[2-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)amino]-2-oxoethyl]amino]acetic acid
CID 60834516
2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]-1-(2,6-dimethylpiperidin-1-yl)ethanone
CID 104979273

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide?
The IUPAC name of 2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide (CID 106599752) is 2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide.
What is the SMILES notation for 2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide?
The canonical SMILES for 2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide is Cc1nnc(NC(=O)CN(CC2CCCN2)C2CC2)o1.
What is the InChIKey of 2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide?
The InChIKey is ULKGCXYBZIEQIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5O2/c1-9-16-17-13(20-9)15-12(19)8-18(11-4-5-11)7-10-3-2-6-14-10/h10-11,14H,2-8H2,1H3,(H,15,17,19).
What are the key properties of 2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide?
2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide has a molecular weight of 279.34 g/mol, XLogP of 0.53, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide is sourced from PubChem (CID 106599752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).