N-[(2S)-2-hydroxypropyl]-2-[methyl(pyrimidin-2-yl)amino]acetamide

C10H16N4O2 — CID 83057842

IUPACN-[(2S)-2-hydroxypropyl]-2-[methyl(pyrimidin-2-yl)amino]acetamide
SMILESC[C@H](O)CNC(=O)CN(C)c1ncccn1
InChIInChI=1S/C10H16N4O2/c1-8(15)6-13-9(16)7-14(2)10-11-4-3-5-12-10/h3-5,8,15H,6-7H2,1-2H3,(H,13,16)/t8-/m0/s1
InChIKeyLMDPKVOTRIYECZ-QMMMGPOBSA-N
MW224.26 g/mol
LogP-0.59
Rot. Bonds5

About N-[(2S)-2-hydroxypropyl]-2-[methyl(pyrimidin-2-yl)amino]acetamide

N-[(2S)-2-hydroxypropyl]-2-[methyl(pyrimidin-2-yl)amino]acetamide (PubChem CID 83057842) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is N-[(2S)-2-hydroxypropyl]-2-[methyl(pyrimidin-2-yl)amino]acetamide.

Molecular Properties

Compound NameN-[(2S)-2-hydroxypropyl]-2-[methyl(pyrimidin-2-yl)amino]acetamide
PubChem CID83057842
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC NameN-[(2S)-2-hydroxypropyl]-2-[methyl(pyrimidin-2-yl)amino]acetamide
SMILESC[C@H](O)CNC(=O)CN(C)c1ncccn1
InChIInChI=1S/C10H16N4O2/c1-8(15)6-13-9(16)7-14(2)10-11-4-3-5-12-10/h3-5,8,15H,6-7H2,1-2H3,(H,13,16)/t8-/m0/s1
InChIKeyLMDPKVOTRIYECZ-QMMMGPOBSA-N
XLogP-0.59
TPSA78.35 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 5-0.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-3-[[2-[methyl(pyrimidin-2-yl)amino]acetyl]amino]propanoic acid
CID 62675666
2-hydroxy-3-[[2-[methyl(pyrimidin-2-yl)amino]acetyl]amino]propanamide
CID 106164955
N-(4-hydroxypentan-2-yl)-2-[methyl(pyrimidin-2-yl)amino]acetamide
CID 113376515
N-(3-hydroxypropyl)-2-[methyl(pyrimidin-2-yl)amino]acetamide
CID 43500389
[2-(2-methylpropylamino)-2-oxoethyl] 2-[methyl(pyrimidin-2-yl)amino]acetate
CID 43063495
N-[[1-(hydroxymethyl)cyclopropyl]methyl]-2-[methyl(pyrimidin-2-yl)amino]acetamide
CID 113313381
6-[[2-[methyl(pyrimidin-2-yl)amino]acetyl]amino]hexanoic acid
CID 43352886
2-[2-[[2-[methyl(pyrimidin-2-yl)amino]acetyl]amino]ethoxy]acetic acid
CID 79457446
methyl 2-[methyl(pyrimidin-2-yl)amino]acetate
CID 60660073
2-[methyl(pyrimidin-2-yl)amino]-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]acetamide
CID 64530410
N-[(2-methylpropan-2-yl)oxy]-2-[methyl(pyrimidin-2-yl)amino]acetamide
CID 82723385
N-ethyl-2-[[3-(1-hydroxyethyl)-2-pyridinyl]-methylamino]acetamide
CID 114055927

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-2-hydroxypropyl]-2-[methyl(pyrimidin-2-yl)amino]acetamide?
The IUPAC name of N-[(2S)-2-hydroxypropyl]-2-[methyl(pyrimidin-2-yl)amino]acetamide (CID 83057842) is N-[(2S)-2-hydroxypropyl]-2-[methyl(pyrimidin-2-yl)amino]acetamide.
What is the SMILES notation for N-[(2S)-2-hydroxypropyl]-2-[methyl(pyrimidin-2-yl)amino]acetamide?
The canonical SMILES for N-[(2S)-2-hydroxypropyl]-2-[methyl(pyrimidin-2-yl)amino]acetamide is C[C@H](O)CNC(=O)CN(C)c1ncccn1.
What is the InChIKey of N-[(2S)-2-hydroxypropyl]-2-[methyl(pyrimidin-2-yl)amino]acetamide?
The InChIKey is LMDPKVOTRIYECZ-QMMMGPOBSA-N. The full InChI is InChI=1S/C10H16N4O2/c1-8(15)6-13-9(16)7-14(2)10-11-4-3-5-12-10/h3-5,8,15H,6-7H2,1-2H3,(H,13,16)/t8-/m0/s1.
What are the key properties of N-[(2S)-2-hydroxypropyl]-2-[methyl(pyrimidin-2-yl)amino]acetamide?
N-[(2S)-2-hydroxypropyl]-2-[methyl(pyrimidin-2-yl)amino]acetamide has a molecular weight of 224.26 g/mol, XLogP of -0.59, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-2-hydroxypropyl]-2-[methyl(pyrimidin-2-yl)amino]acetamide is sourced from PubChem (CID 83057842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).