2-amino-6-methyl-N-[(2R)-2-pyridin-3-yloxypropyl]pyrimidine-4-carboxamide

C14H17N5O2 — CID 95192547

IUPAC2-amino-6-methyl-N-[(2R)-2-pyridin-3-yloxypropyl]pyrimidine-4-carboxamide
SMILESCc1cc(C(=O)NC[C@@H](C)Oc2cccnc2)nc(N)n1
InChIInChI=1S/C14H17N5O2/c1-9-6-12(19-14(15)18-9)13(20)17-7-10(2)21-11-4-3-5-16-8-11/h3-6,8,10H,7H2,1-2H3,(H,17,20)(H2,15,18,19)/t10-/m1/s1
InChIKeyPDKVKLFADFIFJX-SNVBAGLBSA-N
MW287.32 g/mol
LogP0.96
Rot. Bonds5

About 2-amino-6-methyl-N-[(2R)-2-pyridin-3-yloxypropyl]pyrimidine-4-carboxamide

2-amino-6-methyl-N-[(2R)-2-pyridin-3-yloxypropyl]pyrimidine-4-carboxamide (PubChem CID 95192547) has the molecular formula C14H17N5O2 and a molecular weight of 287.32 g/mol. Its IUPAC name is 2-amino-6-methyl-N-[(2R)-2-pyridin-3-yloxypropyl]pyrimidine-4-carboxamide.

Molecular Properties

Compound Name2-amino-6-methyl-N-[(2R)-2-pyridin-3-yloxypropyl]pyrimidine-4-carboxamide
PubChem CID95192547
Molecular FormulaC14H17N5O2
Molecular Weight287.32 g/mol
Exact Mass287.14
IUPAC Name2-amino-6-methyl-N-[(2R)-2-pyridin-3-yloxypropyl]pyrimidine-4-carboxamide
SMILESCc1cc(C(=O)NC[C@@H](C)Oc2cccnc2)nc(N)n1
InChIInChI=1S/C14H17N5O2/c1-9-6-12(19-14(15)18-9)13(20)17-7-10(2)21-11-4-3-5-16-8-11/h3-6,8,10H,7H2,1-2H3,(H,17,20)(H2,15,18,19)/t10-/m1/s1
InChIKeyPDKVKLFADFIFJX-SNVBAGLBSA-N
XLogP0.96
TPSA103.02 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2,5-dimethyl-N-(2-pyridin-3-yloxypropyl)furan-3-carboxamide
CID 90649337
5-cyclopropyl-N-[(2R)-2-pyridin-3-yloxypropyl]-1,2-oxazole-3-carboxamide
CID 126441100
2-amino-6-methyl-N-(2-propan-2-yloxyethyl)pyrimidine-4-carboxamide
CID 114220427
2-ethylsulfanyl-N-[(2R)-2-pyridin-3-yloxypropyl]acetamide
CID 124753809
2-amino-6-methyl-N-(3-methylbutyl)pyrimidine-4-carboxamide
CID 82171955
N-[(2S)-2-pyridin-3-yloxypropyl]-3-(1,2,4-triazol-4-yl)benzamide
CID 95130947
N-[(2R)-2-(3-bromophenoxy)propyl]pyrazine-2-carboxamide
CID 96568538
3-(1,5-dimethylpyrazol-4-yl)-N-[(2S)-2-pyridin-3-yloxypropyl]benzamide
CID 125445501
4-methyl-6-(3-methylbutyl)-2-oxo-N-(2-pyridin-3-yloxypropyl)pyran-3-carboxamide
CID 169421708
1-(4-methoxyphenyl)-N-(2-pyridin-3-yloxypropyl)cyclopentane-1-carboxamide
CID 90649820
1-[(2-fluorophenyl)methyl]-N-[(2S)-2-pyridin-3-yloxypropyl]triazole-4-carboxamide
CID 25289510
4-(4-methylpiperazin-1-yl)-N-(2-pyridin-3-yloxypropyl)benzamide
CID 90653299

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-methyl-N-[(2R)-2-pyridin-3-yloxypropyl]pyrimidine-4-carboxamide?
The IUPAC name of 2-amino-6-methyl-N-[(2R)-2-pyridin-3-yloxypropyl]pyrimidine-4-carboxamide (CID 95192547) is 2-amino-6-methyl-N-[(2R)-2-pyridin-3-yloxypropyl]pyrimidine-4-carboxamide.
What is the SMILES notation for 2-amino-6-methyl-N-[(2R)-2-pyridin-3-yloxypropyl]pyrimidine-4-carboxamide?
The canonical SMILES for 2-amino-6-methyl-N-[(2R)-2-pyridin-3-yloxypropyl]pyrimidine-4-carboxamide is Cc1cc(C(=O)NC[C@@H](C)Oc2cccnc2)nc(N)n1.
What is the InChIKey of 2-amino-6-methyl-N-[(2R)-2-pyridin-3-yloxypropyl]pyrimidine-4-carboxamide?
The InChIKey is PDKVKLFADFIFJX-SNVBAGLBSA-N. The full InChI is InChI=1S/C14H17N5O2/c1-9-6-12(19-14(15)18-9)13(20)17-7-10(2)21-11-4-3-5-16-8-11/h3-6,8,10H,7H2,1-2H3,(H,17,20)(H2,15,18,19)/t10-/m1/s1.
What are the key properties of 2-amino-6-methyl-N-[(2R)-2-pyridin-3-yloxypropyl]pyrimidine-4-carboxamide?
2-amino-6-methyl-N-[(2R)-2-pyridin-3-yloxypropyl]pyrimidine-4-carboxamide has a molecular weight of 287.32 g/mol, XLogP of 0.96, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-methyl-N-[(2R)-2-pyridin-3-yloxypropyl]pyrimidine-4-carboxamide is sourced from PubChem (CID 95192547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).