2-chloro-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)furan-3-carboxamide

C14H19ClN2O2 — CID 106688645

IUPAC2-chloro-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)furan-3-carboxamide
SMILESO=C(c1ccoc1Cl)N(CC1CC1)CC1CCCN1
InChIInChI=1S/C14H19ClN2O2/c15-13-12(5-7-19-13)14(18)17(8-10-3-4-10)9-11-2-1-6-16-11/h5,7,10-11,16H,1-4,6,8-9H2
InChIKeyXUMLLRXNLMYHLQ-UHFFFAOYSA-N
MW282.77 g/mol
LogP2.54
Rot. Bonds5

About 2-chloro-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)furan-3-carboxamide

2-chloro-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)furan-3-carboxamide (PubChem CID 106688645) has the molecular formula C14H19ClN2O2 and a molecular weight of 282.77 g/mol. Its IUPAC name is 2-chloro-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)furan-3-carboxamide.

Molecular Properties

Compound Name2-chloro-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)furan-3-carboxamide
PubChem CID106688645
Molecular FormulaC14H19ClN2O2
Molecular Weight282.77 g/mol
Exact Mass282.11
IUPAC Name2-chloro-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)furan-3-carboxamide
SMILESO=C(c1ccoc1Cl)N(CC1CC1)CC1CCCN1
InChIInChI=1S/C14H19ClN2O2/c15-13-12(5-7-19-13)14(18)17(8-10-3-4-10)9-11-2-1-6-16-11/h5,7,10-11,16H,1-4,6,8-9H2
InChIKeyXUMLLRXNLMYHLQ-UHFFFAOYSA-N
XLogP2.54
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
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-chloro-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)furan-2-carboxamide
CID 106608722
3-chloro-N-(cyclopropylmethyl)-2-fluoro-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106608668
4-chloro-N-(cyclopropylmethyl)-2-hydroxy-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106608308
4-bromo-2-chloro-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106608555
N-(cyclopropylmethyl)-4-hydroxy-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106608699
3-chloro-N-(cyclopropylmethyl)-4-iodo-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106608291
N-(cyclopropylmethyl)-5-methyl-N-(pyrrolidin-2-ylmethyl)furan-2-carboxamide
CID 106608715
N-(cyclopropylmethyl)-2-hydroxy-5-iodo-N-(pyrrolidin-2-ylmethyl)benzamide
CID 107732244
N-(cyclopropylmethyl)-2-hydroxy-4-methyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106608691
N-(cyclopropylmethyl)-2-hydroxy-3-methyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106608359
N-(cyclopropylmethyl)-3,4-dihydroxy-N-(pyrrolidin-2-ylmethyl)benzamide
CID 107728841
2-bromo-N-(cyclopropylmethyl)-4-methyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106608591

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)furan-3-carboxamide?
The IUPAC name of 2-chloro-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)furan-3-carboxamide (CID 106688645) is 2-chloro-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)furan-3-carboxamide.
What is the SMILES notation for 2-chloro-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)furan-3-carboxamide?
The canonical SMILES for 2-chloro-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)furan-3-carboxamide is O=C(c1ccoc1Cl)N(CC1CC1)CC1CCCN1.
What is the InChIKey of 2-chloro-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)furan-3-carboxamide?
The InChIKey is XUMLLRXNLMYHLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O2/c15-13-12(5-7-19-13)14(18)17(8-10-3-4-10)9-11-2-1-6-16-11/h5,7,10-11,16H,1-4,6,8-9H2.
What are the key properties of 2-chloro-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)furan-3-carboxamide?
2-chloro-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)furan-3-carboxamide has a molecular weight of 282.77 g/mol, XLogP of 2.54, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)furan-3-carboxamide is sourced from PubChem (CID 106688645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).