2-[(2-amino-2-oxoethyl)-[[(2R)-pyrrolidin-2-yl]methyl]amino]acetamide

C9H18N4O2 — CID 102819499

IUPAC2-[(2-amino-2-oxoethyl)-[[(2R)-pyrrolidin-2-yl]methyl]amino]acetamide
SMILESNC(=O)CN(CC(N)=O)C[C@H]1CCCN1
InChIInChI=1S/C9H18N4O2/c10-8(14)5-13(6-9(11)15)4-7-2-1-3-12-7/h7,12H,1-6H2,(H2,10,14)(H2,11,15)/t7-/m1/s1
InChIKeyBHQWYCBUUKWWSU-SSDOTTSWSA-N
MW214.27 g/mol
LogP-1.99
Rot. Bonds6

About 2-[(2-amino-2-oxoethyl)-[[(2R)-pyrrolidin-2-yl]methyl]amino]acetamide

2-[(2-amino-2-oxoethyl)-[[(2R)-pyrrolidin-2-yl]methyl]amino]acetamide (PubChem CID 102819499) has the molecular formula C9H18N4O2 and a molecular weight of 214.27 g/mol. Its IUPAC name is 2-[(2-amino-2-oxoethyl)-[[(2R)-pyrrolidin-2-yl]methyl]amino]acetamide.

Molecular Properties

Compound Name2-[(2-amino-2-oxoethyl)-[[(2R)-pyrrolidin-2-yl]methyl]amino]acetamide
PubChem CID102819499
Molecular FormulaC9H18N4O2
Molecular Weight214.27 g/mol
Exact Mass214.14
IUPAC Name2-[(2-amino-2-oxoethyl)-[[(2R)-pyrrolidin-2-yl]methyl]amino]acetamide
SMILESNC(=O)CN(CC(N)=O)C[C@H]1CCCN1
InChIInChI=1S/C9H18N4O2/c10-8(14)5-13(6-9(11)15)4-7-2-1-3-12-7/h7,12H,1-6H2,(H2,10,14)(H2,11,15)/t7-/m1/s1
InChIKeyBHQWYCBUUKWWSU-SSDOTTSWSA-N
XLogP-1.99
TPSA101.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 5-1.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]acetamide
CID 106617908
2-[propan-2-yl-[[(2R)-pyrrolidin-2-yl]methyl]amino]acetamide
CID 102819407
3-[cyclopropylmethyl(pyrrolidin-2-ylmethyl)amino]propanamide
CID 106616433
N-carbamoyl-2-[ethyl(pyrrolidin-2-ylmethyl)amino]acetamide
CID 106615126
N-ethyl-N-(pyrrolidin-2-ylmethyl)ethanamine
CID 4715267
ethyl 2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]acetate
CID 106617961
2-[propan-2-yl(pyrrolidin-2-ylmethyl)amino]propanamide
CID 106614462
N-cyclopentyl-2-[cyclopropylmethyl(pyrrolidin-2-ylmethyl)amino]acetamide
CID 106616532
2-[butyl(pyrrolidin-2-ylmethyl)amino]-N-methylacetamide
CID 106616577
2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]-1-piperidin-1-ylethanone
CID 106618152
2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]-N,N-dipropylacetamide
CID 106617900
3-[ethyl(pyrrolidin-2-ylmethyl)amino]-N,N-dimethylpropanamide
CID 106614989

Frequently Asked Questions

What is the IUPAC name of 2-[(2-amino-2-oxoethyl)-[[(2R)-pyrrolidin-2-yl]methyl]amino]acetamide?
The IUPAC name of 2-[(2-amino-2-oxoethyl)-[[(2R)-pyrrolidin-2-yl]methyl]amino]acetamide (CID 102819499) is 2-[(2-amino-2-oxoethyl)-[[(2R)-pyrrolidin-2-yl]methyl]amino]acetamide.
What is the SMILES notation for 2-[(2-amino-2-oxoethyl)-[[(2R)-pyrrolidin-2-yl]methyl]amino]acetamide?
The canonical SMILES for 2-[(2-amino-2-oxoethyl)-[[(2R)-pyrrolidin-2-yl]methyl]amino]acetamide is NC(=O)CN(CC(N)=O)C[C@H]1CCCN1.
What is the InChIKey of 2-[(2-amino-2-oxoethyl)-[[(2R)-pyrrolidin-2-yl]methyl]amino]acetamide?
The InChIKey is BHQWYCBUUKWWSU-SSDOTTSWSA-N. The full InChI is InChI=1S/C9H18N4O2/c10-8(14)5-13(6-9(11)15)4-7-2-1-3-12-7/h7,12H,1-6H2,(H2,10,14)(H2,11,15)/t7-/m1/s1.
What are the key properties of 2-[(2-amino-2-oxoethyl)-[[(2R)-pyrrolidin-2-yl]methyl]amino]acetamide?
2-[(2-amino-2-oxoethyl)-[[(2R)-pyrrolidin-2-yl]methyl]amino]acetamide has a molecular weight of 214.27 g/mol, XLogP of -1.99, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-amino-2-oxoethyl)-[[(2R)-pyrrolidin-2-yl]methyl]amino]acetamide is sourced from PubChem (CID 102819499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).