N-[(R)-(3-chlorophenyl)-pyridin-2-ylmethyl]-3-(furan-2-yl)propanamide

C19H17ClN2O2 — CID 97084688

IUPACN-[(R)-(3-chlorophenyl)-pyridin-2-ylmethyl]-3-(furan-2-yl)propanamide
SMILESO=C(CCc1ccco1)N[C@H](c1cccc(Cl)c1)c1ccccn1
InChIInChI=1S/C19H17ClN2O2/c20-15-6-3-5-14(13-15)19(17-8-1-2-11-21-17)22-18(23)10-9-16-7-4-12-24-16/h1-8,11-13,19H,9-10H2,(H,22,23)/t19-/m1/s1
InChIKeyOGMLKMHGAYRKKF-LJQANCHMSA-N
MW340.81 g/mol
LogP4.17
Rot. Bonds6

About N-[(R)-(3-chlorophenyl)-pyridin-2-ylmethyl]-3-(furan-2-yl)propanamide

N-[(R)-(3-chlorophenyl)-pyridin-2-ylmethyl]-3-(furan-2-yl)propanamide (PubChem CID 97084688) has the molecular formula C19H17ClN2O2 and a molecular weight of 340.81 g/mol. Its IUPAC name is N-[(R)-(3-chlorophenyl)-pyridin-2-ylmethyl]-3-(furan-2-yl)propanamide.

Molecular Properties

Compound NameN-[(R)-(3-chlorophenyl)-pyridin-2-ylmethyl]-3-(furan-2-yl)propanamide
PubChem CID97084688
Molecular FormulaC19H17ClN2O2
Molecular Weight340.81 g/mol
Exact Mass340.10
IUPAC NameN-[(R)-(3-chlorophenyl)-pyridin-2-ylmethyl]-3-(furan-2-yl)propanamide
SMILESO=C(CCc1ccco1)N[C@H](c1cccc(Cl)c1)c1ccccn1
InChIInChI=1S/C19H17ClN2O2/c20-15-6-3-5-14(13-15)19(17-8-1-2-11-21-17)22-18(23)10-9-16-7-4-12-24-16/h1-8,11-13,19H,9-10H2,(H,22,23)/t19-/m1/s1
InChIKeyOGMLKMHGAYRKKF-LJQANCHMSA-N
XLogP4.17
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.81
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(R)-(3-chlorophenyl)-pyridin-2-ylmethyl]-3-(furan-2-yl)propanamide?
The IUPAC name of N-[(R)-(3-chlorophenyl)-pyridin-2-ylmethyl]-3-(furan-2-yl)propanamide (CID 97084688) is N-[(R)-(3-chlorophenyl)-pyridin-2-ylmethyl]-3-(furan-2-yl)propanamide.
What is the SMILES notation for N-[(R)-(3-chlorophenyl)-pyridin-2-ylmethyl]-3-(furan-2-yl)propanamide?
The canonical SMILES for N-[(R)-(3-chlorophenyl)-pyridin-2-ylmethyl]-3-(furan-2-yl)propanamide is O=C(CCc1ccco1)N[C@H](c1cccc(Cl)c1)c1ccccn1.
What is the InChIKey of N-[(R)-(3-chlorophenyl)-pyridin-2-ylmethyl]-3-(furan-2-yl)propanamide?
The InChIKey is OGMLKMHGAYRKKF-LJQANCHMSA-N. The full InChI is InChI=1S/C19H17ClN2O2/c20-15-6-3-5-14(13-15)19(17-8-1-2-11-21-17)22-18(23)10-9-16-7-4-12-24-16/h1-8,11-13,19H,9-10H2,(H,22,23)/t19-/m1/s1.
What are the key properties of N-[(R)-(3-chlorophenyl)-pyridin-2-ylmethyl]-3-(furan-2-yl)propanamide?
N-[(R)-(3-chlorophenyl)-pyridin-2-ylmethyl]-3-(furan-2-yl)propanamide has a molecular weight of 340.81 g/mol, XLogP of 4.17, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(R)-(3-chlorophenyl)-pyridin-2-ylmethyl]-3-(furan-2-yl)propanamide is sourced from PubChem (CID 97084688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).