2-(cyclopropylmethyl)-4-(1-methoxyethyl)pyrimidine

C11H16N2O — CID 173019556

IUPAC2-(cyclopropylmethyl)-4-(1-methoxyethyl)pyrimidine
SMILESCOC(C)c1ccnc(CC2CC2)n1
InChIInChI=1S/C11H16N2O/c1-8(14-2)10-5-6-12-11(13-10)7-9-3-4-9/h5-6,8-9H,3-4,7H2,1-2H3
InChIKeyIWDABBBKWOAIGP-UHFFFAOYSA-N
MW192.26 g/mol
LogP2.14
Rot. Bonds4

About 2-(cyclopropylmethyl)-4-(1-methoxyethyl)pyrimidine

2-(cyclopropylmethyl)-4-(1-methoxyethyl)pyrimidine (PubChem CID 173019556) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 2-(cyclopropylmethyl)-4-(1-methoxyethyl)pyrimidine.

Molecular Properties

Compound Name2-(cyclopropylmethyl)-4-(1-methoxyethyl)pyrimidine
PubChem CID173019556
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name2-(cyclopropylmethyl)-4-(1-methoxyethyl)pyrimidine
SMILESCOC(C)c1ccnc(CC2CC2)n1
InChIInChI=1S/C11H16N2O/c1-8(14-2)10-5-6-12-11(13-10)7-9-3-4-9/h5-6,8-9H,3-4,7H2,1-2H3
InChIKeyIWDABBBKWOAIGP-UHFFFAOYSA-N
XLogP2.14
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-(dimethoxymethyl)-2-[(2-methyloxan-4-yl)methyl]pyrimidine
CID 142531156
4-(1-methoxyethyl)-2-phenylpyrimidine
CID 141154536
2-(cyclopentylmethyl)pyrimidin-4-amine
CID 70097820
4-chloro-2-(cyclopentylmethyl)pyrimidine
CID 130646601
4-(dimethoxymethyl)-2-(1-methoxyethyl)pyrimidine
CID 115531727
[2-(cyclobutylmethyl)pyrimidin-4-yl]hydrazine
CID 126979837
2-(cyclopentylmethyl)pyrimidine-4-carbaldehyde
CID 126991748
ethane;2-ethyl-4-propan-2-ylpyrimidine
CID 154681512
4-(dimethoxymethyl)-2-(pyridin-4-ylmethyl)pyrimidine
CID 115531673
2-[(1R)-1-methoxyethyl]-6-propan-2-ylpyridine
CID 142501240
4-(pyrimidin-2-ylmethyl)cyclohexan-1-amine
CID 58432562
4-(cyclopropylmethyl)-2-methylpyrimidine
CID 123281493

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethyl)-4-(1-methoxyethyl)pyrimidine?
The IUPAC name of 2-(cyclopropylmethyl)-4-(1-methoxyethyl)pyrimidine (CID 173019556) is 2-(cyclopropylmethyl)-4-(1-methoxyethyl)pyrimidine.
What is the SMILES notation for 2-(cyclopropylmethyl)-4-(1-methoxyethyl)pyrimidine?
The canonical SMILES for 2-(cyclopropylmethyl)-4-(1-methoxyethyl)pyrimidine is COC(C)c1ccnc(CC2CC2)n1.
What is the InChIKey of 2-(cyclopropylmethyl)-4-(1-methoxyethyl)pyrimidine?
The InChIKey is IWDABBBKWOAIGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-8(14-2)10-5-6-12-11(13-10)7-9-3-4-9/h5-6,8-9H,3-4,7H2,1-2H3.
What are the key properties of 2-(cyclopropylmethyl)-4-(1-methoxyethyl)pyrimidine?
2-(cyclopropylmethyl)-4-(1-methoxyethyl)pyrimidine has a molecular weight of 192.26 g/mol, XLogP of 2.14, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethyl)-4-(1-methoxyethyl)pyrimidine is sourced from PubChem (CID 173019556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).