(1-methoxycyclopropyl)-(3-methylpyrrolidin-1-yl)methanone

C10H17NO2 — CID 169181474

IUPAC(1-methoxycyclopropyl)-(3-methylpyrrolidin-1-yl)methanone
SMILESCOC1(C(=O)N2CCC(C)C2)CC1
InChIInChI=1S/C10H17NO2/c1-8-3-6-11(7-8)9(12)10(13-2)4-5-10/h8H,3-7H2,1-2H3
InChIKeyORJBMNHDQBKYGV-UHFFFAOYSA-N
MW183.25 g/mol
LogP1.03
Rot. Bonds2

About (1-methoxycyclopropyl)-(3-methylpyrrolidin-1-yl)methanone

(1-methoxycyclopropyl)-(3-methylpyrrolidin-1-yl)methanone (PubChem CID 169181474) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is (1-methoxycyclopropyl)-(3-methylpyrrolidin-1-yl)methanone.

Molecular Properties

Compound Name(1-methoxycyclopropyl)-(3-methylpyrrolidin-1-yl)methanone
PubChem CID169181474
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC Name(1-methoxycyclopropyl)-(3-methylpyrrolidin-1-yl)methanone
SMILESCOC1(C(=O)N2CCC(C)C2)CC1
InChIInChI=1S/C10H17NO2/c1-8-3-6-11(7-8)9(12)10(13-2)4-5-10/h8H,3-7H2,1-2H3
InChIKeyORJBMNHDQBKYGV-UHFFFAOYSA-N
XLogP1.03
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 51.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(4-methoxypiperidin-4-yl)-(4-methylpiperidin-1-yl)methanone
CID 119675095
ethane;(1-fluorocyclopropyl)-(3-methylpyrrolidin-1-yl)methanone
CID 170766986
(4-methoxypiperidin-4-yl)-[4-(4-methylcyclohexyl)oxypiperidin-1-yl]methanone
CID 119779842
(4-methoxypiperidin-4-yl)-(2-methylthiomorpholin-4-yl)methanone
CID 119774206
(2,4-dimethylpiperazin-1-yl)-(1-methoxycyclopropyl)methanone
CID 177202718
[1-(3-methoxyoxolane-3-carbonyl)pyrrolidin-3-yl]boronic acid
CID 154767085
(4-methoxypiperidin-4-yl)-[3-(piperidin-1-ylmethyl)pyrrolidin-1-yl]methanone
CID 119894734
2-methoxy-1-[(3S)-3-methylpyrrolidin-1-yl]ethanone
CID 145013525
3-methyl-1-(3-methylpyrrolidine-1-carbonyl)cyclobutane-1-carbonitrile
CID 80501516
[3-(diethylaminomethyl)pyrrolidin-1-yl]-(4-methoxypiperidin-4-yl)methanone;dihydrochloride
CID 119894888
[4-[(dimethylamino)methyl]piperidin-1-yl]-(4-methoxypiperidin-4-yl)methanone
CID 119852056
(3-fluoropyrrolidin-3-yl)-(3-methylpyrrolidin-1-yl)methanone
CID 130747822

Frequently Asked Questions

What is the IUPAC name of (1-methoxycyclopropyl)-(3-methylpyrrolidin-1-yl)methanone?
The IUPAC name of (1-methoxycyclopropyl)-(3-methylpyrrolidin-1-yl)methanone (CID 169181474) is (1-methoxycyclopropyl)-(3-methylpyrrolidin-1-yl)methanone.
What is the SMILES notation for (1-methoxycyclopropyl)-(3-methylpyrrolidin-1-yl)methanone?
The canonical SMILES for (1-methoxycyclopropyl)-(3-methylpyrrolidin-1-yl)methanone is COC1(C(=O)N2CCC(C)C2)CC1.
What is the InChIKey of (1-methoxycyclopropyl)-(3-methylpyrrolidin-1-yl)methanone?
The InChIKey is ORJBMNHDQBKYGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c1-8-3-6-11(7-8)9(12)10(13-2)4-5-10/h8H,3-7H2,1-2H3.
What are the key properties of (1-methoxycyclopropyl)-(3-methylpyrrolidin-1-yl)methanone?
(1-methoxycyclopropyl)-(3-methylpyrrolidin-1-yl)methanone has a molecular weight of 183.25 g/mol, XLogP of 1.03, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methoxycyclopropyl)-(3-methylpyrrolidin-1-yl)methanone is sourced from PubChem (CID 169181474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).