1-cyclopropyl-3-(3,4-dihydro-2H-pyran-2-ylmethyl)urea

C10H16N2O2 — CID 131162498

IUPAC1-cyclopropyl-3-(3,4-dihydro-2H-pyran-2-ylmethyl)urea
SMILESO=C(NCC1CCC=CO1)NC1CC1
InChIInChI=1S/C10H16N2O2/c13-10(12-8-4-5-8)11-7-9-3-1-2-6-14-9/h2,6,8-9H,1,3-5,7H2,(H2,11,12,13)
InChIKeyGLQUYZKODRONFS-UHFFFAOYSA-N
MW196.25 g/mol
LogP1.14
Rot. Bonds3

About 1-cyclopropyl-3-(3,4-dihydro-2H-pyran-2-ylmethyl)urea

1-cyclopropyl-3-(3,4-dihydro-2H-pyran-2-ylmethyl)urea (PubChem CID 131162498) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 1-cyclopropyl-3-(3,4-dihydro-2H-pyran-2-ylmethyl)urea.

Molecular Properties

Compound Name1-cyclopropyl-3-(3,4-dihydro-2H-pyran-2-ylmethyl)urea
PubChem CID131162498
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name1-cyclopropyl-3-(3,4-dihydro-2H-pyran-2-ylmethyl)urea
SMILESO=C(NCC1CCC=CO1)NC1CC1
InChIInChI=1S/C10H16N2O2/c13-10(12-8-4-5-8)11-7-9-3-1-2-6-14-9/h2,6,8-9H,1,3-5,7H2,(H2,11,12,13)
InChIKeyGLQUYZKODRONFS-UHFFFAOYSA-N
XLogP1.14
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 51.14
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
1-(3,4-dihydro-2H-pyran-2-ylmethyl)-3-[2-(dimethylamino)ethyl]urea;ethane
CID 143819458
N-cyclopropyl-3-(3,4-dihydro-2H-pyran-2-ylmethylamino)propanamide
CID 79385690
N-cyclopropyl-4-(3,4-dihydro-2H-pyran-2-ylmethylamino)butanamide
CID 79394422
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
3,4-dihydro-2H-pyran-2-ylmethylurea
CID 130625744
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

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-(3,4-dihydro-2H-pyran-2-ylmethyl)urea?
The IUPAC name of 1-cyclopropyl-3-(3,4-dihydro-2H-pyran-2-ylmethyl)urea (CID 131162498) is 1-cyclopropyl-3-(3,4-dihydro-2H-pyran-2-ylmethyl)urea.
What is the SMILES notation for 1-cyclopropyl-3-(3,4-dihydro-2H-pyran-2-ylmethyl)urea?
The canonical SMILES for 1-cyclopropyl-3-(3,4-dihydro-2H-pyran-2-ylmethyl)urea is O=C(NCC1CCC=CO1)NC1CC1.
What is the InChIKey of 1-cyclopropyl-3-(3,4-dihydro-2H-pyran-2-ylmethyl)urea?
The InChIKey is GLQUYZKODRONFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c13-10(12-8-4-5-8)11-7-9-3-1-2-6-14-9/h2,6,8-9H,1,3-5,7H2,(H2,11,12,13).
What are the key properties of 1-cyclopropyl-3-(3,4-dihydro-2H-pyran-2-ylmethyl)urea?
1-cyclopropyl-3-(3,4-dihydro-2H-pyran-2-ylmethyl)urea has a molecular weight of 196.25 g/mol, XLogP of 1.14, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-(3,4-dihydro-2H-pyran-2-ylmethyl)urea is sourced from PubChem (CID 131162498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).