3,4-dihydro-2H-pyran-2-ylmethylurea

C7H12N2O2 — CID 130625744

IUPAC3,4-dihydro-2H-pyran-2-ylmethylurea
SMILESNC(=O)NCC1CCC=CO1
InChIInChI=1S/C7H12N2O2/c8-7(10)9-5-6-3-1-2-4-11-6/h2,4,6H,1,3,5H2,(H3,8,9,10)
InChIKeyOCSWBOWSYKHQHA-UHFFFAOYSA-N
MW156.19 g/mol
LogP0.35
Rot. Bonds2

About 3,4-dihydro-2H-pyran-2-ylmethylurea

3,4-dihydro-2H-pyran-2-ylmethylurea (PubChem CID 130625744) has the molecular formula C7H12N2O2 and a molecular weight of 156.19 g/mol. Its IUPAC name is 3,4-dihydro-2H-pyran-2-ylmethylurea.

Molecular Properties

Compound Name3,4-dihydro-2H-pyran-2-ylmethylurea
PubChem CID130625744
Molecular FormulaC7H12N2O2
Molecular Weight156.19 g/mol
Exact Mass156.09
IUPAC Name3,4-dihydro-2H-pyran-2-ylmethylurea
SMILESNC(=O)NCC1CCC=CO1
InChIInChI=1S/C7H12N2O2/c8-7(10)9-5-6-3-1-2-4-11-6/h2,4,6H,1,3,5H2,(H3,8,9,10)
InChIKeyOCSWBOWSYKHQHA-UHFFFAOYSA-N
XLogP0.35
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.19
LogP ≤ 50.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(R)-1-(3,4-Dihydro-2H-pyran-2-yl)methyl]-3-(2-dimethylamino-ethyl)urea
CID 46185757
1-(3,4-dihydro-2H-pyran-2-ylmethyl)-3-[2-(dimethylamino)ethyl]urea
CID 68735262
2,3-Dihydrofuran-2-ylmethylurea
CID 88997485
3,4-dihydro-2H-pyran-2-ylmethylcarbamic acid
CID 138697147
1-(3,4-dihydro-2H-pyran-2-ylmethyl)-3-[2-(dimethylamino)ethyl]urea;ethane
CID 143819458
1-(2,3-Dihydrofuran-2-yl)ethylurea
CID 153684725
2-(3,4-dihydro-2H-pyran-2-ylmethylamino)ethylurea
CID 83109324
3-[2-(3,4-dihydro-2H-pyran-2-ylmethylamino)ethyl]-1,1-dimethylurea
CID 83116673
1-(3,4-dihydro-2H-pyran-2-ylmethyl)-3-methylurea
CID 130657465
1-(3,4-dihydro-2H-pyran-2-ylmethyl)-3-methoxyurea
CID 130684409
3-(3,4-dihydro-2H-pyran-2-ylmethyl)-1,1-dimethylurea
CID 130693357
Methyl [(3,4-dihydro-2H-pyran-2-yl)methyl]carbamate
CID 130742033

Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-pyran-2-ylmethylurea?
The IUPAC name of 3,4-dihydro-2H-pyran-2-ylmethylurea (CID 130625744) is 3,4-dihydro-2H-pyran-2-ylmethylurea.
What is the SMILES notation for 3,4-dihydro-2H-pyran-2-ylmethylurea?
The canonical SMILES for 3,4-dihydro-2H-pyran-2-ylmethylurea is NC(=O)NCC1CCC=CO1.
What is the InChIKey of 3,4-dihydro-2H-pyran-2-ylmethylurea?
The InChIKey is OCSWBOWSYKHQHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O2/c8-7(10)9-5-6-3-1-2-4-11-6/h2,4,6H,1,3,5H2,(H3,8,9,10).
What are the key properties of 3,4-dihydro-2H-pyran-2-ylmethylurea?
3,4-dihydro-2H-pyran-2-ylmethylurea has a molecular weight of 156.19 g/mol, XLogP of 0.35, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dihydro-2H-pyran-2-ylmethylurea is sourced from PubChem (CID 130625744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).