N-cyclopropyl-2-[[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]amino]pyridine-4-carboxamide

C19H22N4O3 — CID 91761162

IUPACN-cyclopropyl-2-[[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]amino]pyridine-4-carboxamide
SMILESO=C(NC1CC1)c1ccnc(N[C@@H]2COCC[C@H]2Oc2ccccn2)c1
InChIInChI=1S/C19H22N4O3/c24-19(22-14-4-5-14)13-6-9-20-17(11-13)23-15-12-25-10-7-16(15)26-18-3-1-2-8-21-18/h1-3,6,8-9,11,14-16H,4-5,7,10,12H2,(H,20,23)(H,22,24)/t15-,16-/m1/s1
InChIKeyNKCCNGKXFCIJDX-HZPDHXFCSA-N
MW354.41 g/mol
LogP2.02
Rot. Bonds6

About N-cyclopropyl-2-[[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]amino]pyridine-4-carboxamide

N-cyclopropyl-2-[[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]amino]pyridine-4-carboxamide (PubChem CID 91761162) has the molecular formula C19H22N4O3 and a molecular weight of 354.41 g/mol. Its IUPAC name is N-cyclopropyl-2-[[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]amino]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]amino]pyridine-4-carboxamide
PubChem CID91761162
Molecular FormulaC19H22N4O3
Molecular Weight354.41 g/mol
Exact Mass354.17
IUPAC NameN-cyclopropyl-2-[[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]amino]pyridine-4-carboxamide
SMILESO=C(NC1CC1)c1ccnc(N[C@@H]2COCC[C@H]2Oc2ccccn2)c1
InChIInChI=1S/C19H22N4O3/c24-19(22-14-4-5-14)13-6-9-20-17(11-13)23-15-12-25-10-7-16(15)26-18-3-1-2-8-21-18/h1-3,6,8-9,11,14-16H,4-5,7,10,12H2,(H,20,23)(H,22,24)/t15-,16-/m1/s1
InChIKeyNKCCNGKXFCIJDX-HZPDHXFCSA-N
XLogP2.02
TPSA85.37 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.41
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-cyclopropyl-2-[[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]amino]pyridine-4-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]-1H-pyrazole-4-carboxamide
CID 91773229
6-cyclopropyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyrimidin-4-amine
CID 91771738
N-[2-oxo-2-[(4-pyridin-2-yloxyoxan-3-yl)amino]ethyl]benzamide
CID 156608743
3-amino-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]thiophene-2-carboxamide
CID 91764238
5-(methoxymethyl)-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]thiophene-2-carboxamide
CID 91798306
4-(2-methyltetrazol-5-yl)-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]benzamide
CID 91771219
1,1-di(propan-2-yl)-3-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]urea
CID 91777188
2-(dimethylamino)-4-methyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyrimidine-5-carboxamide
CID 91791524
1-phenyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]cyclopropane-1-carboxamide
CID 91795536
N-cyclododecyl-2-(oxolan-3-yloxy)pyridine-4-carboxamide
CID 121160706
N-cyclohexyl-2-(oxolan-3-yloxy)pyridine-4-carboxamide
CID 91815236
2-methylsulfanyl-N-(4-pyridin-2-yloxyoxan-3-yl)-1,3-thiazole-4-carboxamide
CID 156608294

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]amino]pyridine-4-carboxamide?
The IUPAC name of N-cyclopropyl-2-[[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]amino]pyridine-4-carboxamide (CID 91761162) is N-cyclopropyl-2-[[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]amino]pyridine-4-carboxamide.
What is the SMILES notation for N-cyclopropyl-2-[[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]amino]pyridine-4-carboxamide?
The canonical SMILES for N-cyclopropyl-2-[[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]amino]pyridine-4-carboxamide is O=C(NC1CC1)c1ccnc(N[C@@H]2COCC[C@H]2Oc2ccccn2)c1.
What is the InChIKey of N-cyclopropyl-2-[[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]amino]pyridine-4-carboxamide?
The InChIKey is NKCCNGKXFCIJDX-HZPDHXFCSA-N. The full InChI is InChI=1S/C19H22N4O3/c24-19(22-14-4-5-14)13-6-9-20-17(11-13)23-15-12-25-10-7-16(15)26-18-3-1-2-8-21-18/h1-3,6,8-9,11,14-16H,4-5,7,10,12H2,(H,20,23)(H,22,24)/t15-,16-/m1/s1.
What are the key properties of N-cyclopropyl-2-[[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]amino]pyridine-4-carboxamide?
N-cyclopropyl-2-[[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]amino]pyridine-4-carboxamide has a molecular weight of 354.41 g/mol, XLogP of 2.02, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]amino]pyridine-4-carboxamide is sourced from PubChem (CID 91761162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).