(2S)-2-cyclopropyl-2-propoxy-N-(6-propoxy-3-pyridinyl)propanamide

C17H26N2O3 — CID 100778739

IUPAC(2S)-2-cyclopropyl-2-propoxy-N-(6-propoxy-3-pyridinyl)propanamide
SMILESCCCOc1ccc(NC(=O)[C@@](C)(OCCC)C2CC2)cn1
InChIInChI=1S/C17H26N2O3/c1-4-10-21-15-9-8-14(12-18-15)19-16(20)17(3,13-6-7-13)22-11-5-2/h8-9,12-13H,4-7,10-11H2,1-3H3,(H,19,20)/t17-/m0/s1
InChIKeyBPIJWJDAJVROGI-KRWDZBQOSA-N
MW306.41 g/mol
LogP3.40
Rot. Bonds9

About (2S)-2-cyclopropyl-2-propoxy-N-(6-propoxy-3-pyridinyl)propanamide

(2S)-2-cyclopropyl-2-propoxy-N-(6-propoxy-3-pyridinyl)propanamide (PubChem CID 100778739) has the molecular formula C17H26N2O3 and a molecular weight of 306.41 g/mol. Its IUPAC name is (2S)-2-cyclopropyl-2-propoxy-N-(6-propoxy-3-pyridinyl)propanamide.

Molecular Properties

Compound Name(2S)-2-cyclopropyl-2-propoxy-N-(6-propoxy-3-pyridinyl)propanamide
PubChem CID100778739
Molecular FormulaC17H26N2O3
Molecular Weight306.41 g/mol
Exact Mass306.19
IUPAC Name(2S)-2-cyclopropyl-2-propoxy-N-(6-propoxy-3-pyridinyl)propanamide
SMILESCCCOc1ccc(NC(=O)[C@@](C)(OCCC)C2CC2)cn1
InChIInChI=1S/C17H26N2O3/c1-4-10-21-15-9-8-14(12-18-15)19-16(20)17(3,13-6-7-13)22-11-5-2/h8-9,12-13H,4-7,10-11H2,1-3H3,(H,19,20)/t17-/m0/s1
InChIKeyBPIJWJDAJVROGI-KRWDZBQOSA-N
XLogP3.40
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-cyclopropyl-N-(6-ethoxy-3-pyridinyl)-2-methoxypropanamide
CID 100775745
(2S)-2-cyclopropyl-N-(6-ethoxy-3-pyridinyl)-2-methoxypropanamide
CID 100775742
(2R)-2-methyl-2-propoxy-N-(6-propoxy-3-pyridinyl)butanamide
CID 100777566
(2R)-N-(4-butoxyphenyl)-2-cyclopropyl-2-propoxypropanamide
CID 100717361
(2R)-N-(3-chloro-4-propoxyphenyl)-2-cyclopropyl-2-propoxypropanamide
CID 100718617
(2S)-2-cyclopropyl-N-(5-methyl-6-propoxy-3-pyridinyl)-2-propoxypropanamide
CID 100778809
(2S)-2-methyl-2-propoxy-N-(6-propoxy-3-pyridinyl)hexanamide
CID 100778007
2-methyl-2-propoxy-N-(6-propoxy-3-pyridinyl)hexanamide
CID 133205914
N-(3-cyano-4-propoxyphenyl)-2-cyclopropyl-2-propoxypropanamide
CID 133205489
(2R)-2-ethoxy-2-methyl-N-(6-propoxy-3-pyridinyl)heptanamide
CID 100776755
(2R)-N-(6-butoxy-3-pyridinyl)-2-methyl-2-propoxyheptanamide
CID 100778152
ethyl 5-[[(2S)-2-cyclopropyl-2-propoxypropanoyl]amino]-2-propoxybenzoate
CID 100768779

Frequently Asked Questions

What is the IUPAC name of (2S)-2-cyclopropyl-2-propoxy-N-(6-propoxy-3-pyridinyl)propanamide?
The IUPAC name of (2S)-2-cyclopropyl-2-propoxy-N-(6-propoxy-3-pyridinyl)propanamide (CID 100778739) is (2S)-2-cyclopropyl-2-propoxy-N-(6-propoxy-3-pyridinyl)propanamide.
What is the SMILES notation for (2S)-2-cyclopropyl-2-propoxy-N-(6-propoxy-3-pyridinyl)propanamide?
The canonical SMILES for (2S)-2-cyclopropyl-2-propoxy-N-(6-propoxy-3-pyridinyl)propanamide is CCCOc1ccc(NC(=O)[C@@](C)(OCCC)C2CC2)cn1.
What is the InChIKey of (2S)-2-cyclopropyl-2-propoxy-N-(6-propoxy-3-pyridinyl)propanamide?
The InChIKey is BPIJWJDAJVROGI-KRWDZBQOSA-N. The full InChI is InChI=1S/C17H26N2O3/c1-4-10-21-15-9-8-14(12-18-15)19-16(20)17(3,13-6-7-13)22-11-5-2/h8-9,12-13H,4-7,10-11H2,1-3H3,(H,19,20)/t17-/m0/s1.
What are the key properties of (2S)-2-cyclopropyl-2-propoxy-N-(6-propoxy-3-pyridinyl)propanamide?
(2S)-2-cyclopropyl-2-propoxy-N-(6-propoxy-3-pyridinyl)propanamide has a molecular weight of 306.41 g/mol, XLogP of 3.40, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-cyclopropyl-2-propoxy-N-(6-propoxy-3-pyridinyl)propanamide is sourced from PubChem (CID 100778739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).