N-[(2R)-1-(methylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide

C9H18N4O2 — CID 167160475

IUPACN-[(2R)-1-(methylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide
SMILESCNC(=O)[C@@H](C)NC(=O)C1CNCCN1
InChIInChI=1S/C9H18N4O2/c1-6(8(14)10-2)13-9(15)7-5-11-3-4-12-7/h6-7,11-12H,3-5H2,1-2H3,(H,10,14)(H,13,15)/t6-,7?/m1/s1
InChIKeyPEMDPKTWAPQUMT-ULUSZKPHSA-N
MW214.27 g/mol
LogP-2.20
Rot. Bonds3

About N-[(2R)-1-(methylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide

N-[(2R)-1-(methylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide (PubChem CID 167160475) has the molecular formula C9H18N4O2 and a molecular weight of 214.27 g/mol. Its IUPAC name is N-[(2R)-1-(methylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide.

Molecular Properties

Compound NameN-[(2R)-1-(methylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide
PubChem CID167160475
Molecular FormulaC9H18N4O2
Molecular Weight214.27 g/mol
Exact Mass214.14
IUPAC NameN-[(2R)-1-(methylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide
SMILESCNC(=O)[C@@H](C)NC(=O)C1CNCCN1
InChIInChI=1S/C9H18N4O2/c1-6(8(14)10-2)13-9(15)7-5-11-3-4-12-7/h6-7,11-12H,3-5H2,1-2H3,(H,10,14)(H,13,15)/t6-,7?/m1/s1
InChIKeyPEMDPKTWAPQUMT-ULUSZKPHSA-N
XLogP-2.20
TPSA82.26 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 5-2.20
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(ethylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide
CID 63103460
(2S)-N-[1-(methylamino)-1-oxopropan-2-yl]pyrrolidine-2-carboxamide
CID 61467430
N-[1-(diethylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide
CID 113408616
N-[(2S)-1-(methylamino)-1-oxopropan-2-yl]-1,3-thiazolidine-4-carboxamide
CID 164654399
6-methyl-N-[1-(methylamino)-1-oxopropan-2-yl]piperidine-2-carboxamide
CID 61467409
3-methyl-N-[1-(methylamino)-1-oxopropan-2-yl]piperidine-2-carboxamide
CID 62340143
N-cyclopropylpiperazine-2-carboxamide
CID 83806832
(2R,3S)-2-methyl-N-[(2R)-1-(methylamino)-1-oxopropan-2-yl]morpholine-3-carboxamide
CID 120933426
N-(4-acetamidophenyl)piperazine-2-carboxamide
CID 63103626
2-[[2-(azetidin-3-yl)acetyl]amino]-N-methylpropanamide
CID 64611012
N-(2,2-dimethylpropyl)piperazine-2-carboxamide
CID 63103456
1-(1,4,7,10-tetrazacyclododec-2-yl)ethanone
CID 22113791

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-(methylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide?
The IUPAC name of N-[(2R)-1-(methylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide (CID 167160475) is N-[(2R)-1-(methylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide.
What is the SMILES notation for N-[(2R)-1-(methylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide?
The canonical SMILES for N-[(2R)-1-(methylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide is CNC(=O)[C@@H](C)NC(=O)C1CNCCN1.
What is the InChIKey of N-[(2R)-1-(methylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide?
The InChIKey is PEMDPKTWAPQUMT-ULUSZKPHSA-N. The full InChI is InChI=1S/C9H18N4O2/c1-6(8(14)10-2)13-9(15)7-5-11-3-4-12-7/h6-7,11-12H,3-5H2,1-2H3,(H,10,14)(H,13,15)/t6-,7?/m1/s1.
What are the key properties of N-[(2R)-1-(methylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide?
N-[(2R)-1-(methylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide has a molecular weight of 214.27 g/mol, XLogP of -2.20, 3 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-(methylamino)-1-oxopropan-2-yl]piperazine-2-carboxamide is sourced from PubChem (CID 167160475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).