N-cyclopropyl-2-[(6-hydrazinyl-2-propylpyrimidin-4-yl)-methylamino]acetamide

C13H22N6O — CID 80947351

IUPACN-cyclopropyl-2-[(6-hydrazinyl-2-propylpyrimidin-4-yl)-methylamino]acetamide
SMILESCCCc1nc(NN)cc(N(C)CC(=O)NC2CC2)n1
InChIInChI=1S/C13H22N6O/c1-3-4-10-16-11(18-14)7-12(17-10)19(2)8-13(20)15-9-5-6-9/h7,9H,3-6,8,14H2,1-2H3,(H,15,20)(H,16,17,18)
InChIKeyDVNPZQKHCQTBNW-UHFFFAOYSA-N
MW278.36 g/mol
LogP0.43
Rot. Bonds7

About N-cyclopropyl-2-[(6-hydrazinyl-2-propylpyrimidin-4-yl)-methylamino]acetamide

N-cyclopropyl-2-[(6-hydrazinyl-2-propylpyrimidin-4-yl)-methylamino]acetamide (PubChem CID 80947351) has the molecular formula C13H22N6O and a molecular weight of 278.36 g/mol. Its IUPAC name is N-cyclopropyl-2-[(6-hydrazinyl-2-propylpyrimidin-4-yl)-methylamino]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[(6-hydrazinyl-2-propylpyrimidin-4-yl)-methylamino]acetamide
PubChem CID80947351
Molecular FormulaC13H22N6O
Molecular Weight278.36 g/mol
Exact Mass278.19
IUPAC NameN-cyclopropyl-2-[(6-hydrazinyl-2-propylpyrimidin-4-yl)-methylamino]acetamide
SMILESCCCc1nc(NN)cc(N(C)CC(=O)NC2CC2)n1
InChIInChI=1S/C13H22N6O/c1-3-4-10-16-11(18-14)7-12(17-10)19(2)8-13(20)15-9-5-6-9/h7,9H,3-6,8,14H2,1-2H3,(H,15,20)(H,16,17,18)
InChIKeyDVNPZQKHCQTBNW-UHFFFAOYSA-N
XLogP0.43
TPSA96.17 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 50.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-cyclopropyl-2-[[6-(ethylamino)-2-propylpyrimidin-4-yl]-methylamino]acetamide
CID 80941047
N-cyclopropyl-2-[[2-ethyl-6-(ethylamino)pyrimidin-4-yl]-methylamino]acetamide
CID 80934592
N-cyclopropyl-2-[[6-hydrazinyl-2-(trifluoromethyl)pyrimidin-4-yl]-methylamino]acetamide
CID 106775558
2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-methylamino]-N-cyclopropylacetamide
CID 80983230
N-ethyl-2-[[6-hydrazinyl-2-(methoxymethyl)pyrimidin-4-yl]-methylamino]acetamide
CID 113401806
N-cyclopropyl-2-[[2-cyclopropyl-6-(methylamino)pyrimidin-4-yl]-methylamino]acetamide
CID 80960767
N-cyclopropyl-2-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]acetamide
CID 80955065
2-[(6-amino-2-methylsulfanylpyrimidin-4-yl)-methylamino]-N-cyclopropylacetamide
CID 80820565
2-[butyl-(6-hydrazinyl-2-propylpyrimidin-4-yl)amino]acetamide
CID 80947162
2-[(2-cyclopropyl-6-hydrazinylpyrimidin-4-yl)-methylamino]-N,N-diethylacetamide
CID 80963769
N-[(4-chlorophenyl)methyl]-6-hydrazinyl-N-methyl-2-propylpyrimidin-4-amine
CID 80943087
6-hydrazinyl-N-methyl-N-(2-propan-2-yloxyethyl)-2-propylpyrimidin-4-amine
CID 81064970

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[(6-hydrazinyl-2-propylpyrimidin-4-yl)-methylamino]acetamide?
The IUPAC name of N-cyclopropyl-2-[(6-hydrazinyl-2-propylpyrimidin-4-yl)-methylamino]acetamide (CID 80947351) is N-cyclopropyl-2-[(6-hydrazinyl-2-propylpyrimidin-4-yl)-methylamino]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[(6-hydrazinyl-2-propylpyrimidin-4-yl)-methylamino]acetamide?
The canonical SMILES for N-cyclopropyl-2-[(6-hydrazinyl-2-propylpyrimidin-4-yl)-methylamino]acetamide is CCCc1nc(NN)cc(N(C)CC(=O)NC2CC2)n1.
What is the InChIKey of N-cyclopropyl-2-[(6-hydrazinyl-2-propylpyrimidin-4-yl)-methylamino]acetamide?
The InChIKey is DVNPZQKHCQTBNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N6O/c1-3-4-10-16-11(18-14)7-12(17-10)19(2)8-13(20)15-9-5-6-9/h7,9H,3-6,8,14H2,1-2H3,(H,15,20)(H,16,17,18).
What are the key properties of N-cyclopropyl-2-[(6-hydrazinyl-2-propylpyrimidin-4-yl)-methylamino]acetamide?
N-cyclopropyl-2-[(6-hydrazinyl-2-propylpyrimidin-4-yl)-methylamino]acetamide has a molecular weight of 278.36 g/mol, XLogP of 0.43, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[(6-hydrazinyl-2-propylpyrimidin-4-yl)-methylamino]acetamide is sourced from PubChem (CID 80947351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).