(5-chlorofuran-2-yl)-[4-(cyclopropylmethylamino)piperidin-1-yl]methanone

C14H19ClN2O2 — CID 81483493

IUPAC(5-chlorofuran-2-yl)-[4-(cyclopropylmethylamino)piperidin-1-yl]methanone
SMILESO=C(c1ccc(Cl)o1)N1CCC(NCC2CC2)CC1
InChIInChI=1S/C14H19ClN2O2/c15-13-4-3-12(19-13)14(18)17-7-5-11(6-8-17)16-9-10-1-2-10/h3-4,10-11,16H,1-2,5-9H2
InChIKeySBCQPBXCTSXWHD-UHFFFAOYSA-N
MW282.77 g/mol
LogP2.54
Rot. Bonds4

About (5-chlorofuran-2-yl)-[4-(cyclopropylmethylamino)piperidin-1-yl]methanone

(5-chlorofuran-2-yl)-[4-(cyclopropylmethylamino)piperidin-1-yl]methanone (PubChem CID 81483493) has the molecular formula C14H19ClN2O2 and a molecular weight of 282.77 g/mol. Its IUPAC name is (5-chlorofuran-2-yl)-[4-(cyclopropylmethylamino)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(5-chlorofuran-2-yl)-[4-(cyclopropylmethylamino)piperidin-1-yl]methanone
PubChem CID81483493
Molecular FormulaC14H19ClN2O2
Molecular Weight282.77 g/mol
Exact Mass282.11
IUPAC Name(5-chlorofuran-2-yl)-[4-(cyclopropylmethylamino)piperidin-1-yl]methanone
SMILESO=C(c1ccc(Cl)o1)N1CCC(NCC2CC2)CC1
InChIInChI=1S/C14H19ClN2O2/c15-13-4-3-12(19-13)14(18)17-7-5-11(6-8-17)16-9-10-1-2-10/h3-4,10-11,16H,1-2,5-9H2
InChIKeySBCQPBXCTSXWHD-UHFFFAOYSA-N
XLogP2.54
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.77
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(5-chlorofuran-2-yl)-[4-(ethylaminomethyl)piperidin-1-yl]methanone
CID 80551638
[4-(cyclopropylmethylamino)piperidin-1-yl]-(5-nitrofuran-2-yl)methanone
CID 81485588
(2-chlorophenyl)-[4-(cyclopropylmethylamino)piperidin-1-yl]methanone
CID 81297532
[4-(cyclopropylmethylamino)piperidin-1-yl]-(2,5-dichlorophenyl)methanone
CID 81487303
2-(4-bromophenyl)-1-[4-(cyclopropylmethylamino)piperidin-1-yl]ethanone;hydrochloride
CID 119623627
[4-(cyclopropylmethylamino)piperidin-1-yl]-(3,4-dichlorophenyl)methanone;hydrochloride
CID 119621638
5-[4-(cyclopropylmethylamino)piperidine-1-carbonyl]pyran-2-one
CID 115307125
(2-chloro-5-hydroxyphenyl)-[4-(cyclopropylmethylamino)piperidin-1-yl]methanone
CID 106502684
(5-chlorofuran-2-yl)-[4-(trifluoromethyl)piperidin-1-yl]methanone
CID 113245179
(5-chlorofuran-2-yl)-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone
CID 113226423
(5-chloro-2-fluorophenyl)-[4-(cyclopropylmethylamino)piperidin-1-yl]methanone;hydrochloride
CID 119624175
[4-(cyclopropylmethylamino)piperidin-1-yl]-(4-fluorophenyl)methanone
CID 81483492

Frequently Asked Questions

What is the IUPAC name of (5-chlorofuran-2-yl)-[4-(cyclopropylmethylamino)piperidin-1-yl]methanone?
The IUPAC name of (5-chlorofuran-2-yl)-[4-(cyclopropylmethylamino)piperidin-1-yl]methanone (CID 81483493) is (5-chlorofuran-2-yl)-[4-(cyclopropylmethylamino)piperidin-1-yl]methanone.
What is the SMILES notation for (5-chlorofuran-2-yl)-[4-(cyclopropylmethylamino)piperidin-1-yl]methanone?
The canonical SMILES for (5-chlorofuran-2-yl)-[4-(cyclopropylmethylamino)piperidin-1-yl]methanone is O=C(c1ccc(Cl)o1)N1CCC(NCC2CC2)CC1.
What is the InChIKey of (5-chlorofuran-2-yl)-[4-(cyclopropylmethylamino)piperidin-1-yl]methanone?
The InChIKey is SBCQPBXCTSXWHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O2/c15-13-4-3-12(19-13)14(18)17-7-5-11(6-8-17)16-9-10-1-2-10/h3-4,10-11,16H,1-2,5-9H2.
What are the key properties of (5-chlorofuran-2-yl)-[4-(cyclopropylmethylamino)piperidin-1-yl]methanone?
(5-chlorofuran-2-yl)-[4-(cyclopropylmethylamino)piperidin-1-yl]methanone has a molecular weight of 282.77 g/mol, XLogP of 2.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chlorofuran-2-yl)-[4-(cyclopropylmethylamino)piperidin-1-yl]methanone is sourced from PubChem (CID 81483493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).