3-amino-2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]propanamide

C14H23N3O2 — CID 115426650

IUPAC3-amino-2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]propanamide
SMILESCC(C)Oc1ncccc1CNC(=O)C(C)(C)CN
InChIInChI=1S/C14H23N3O2/c1-10(2)19-12-11(6-5-7-16-12)8-17-13(18)14(3,4)9-15/h5-7,10H,8-9,15H2,1-4H3,(H,17,18)
InChIKeyJVUHVSBMGDTVHS-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.47
Rot. Bonds6

About 3-amino-2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]propanamide

3-amino-2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]propanamide (PubChem CID 115426650) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is 3-amino-2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]propanamide.

Molecular Properties

Compound Name3-amino-2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]propanamide
PubChem CID115426650
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name3-amino-2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]propanamide
SMILESCC(C)Oc1ncccc1CNC(=O)C(C)(C)CN
InChIInChI=1S/C14H23N3O2/c1-10(2)19-12-11(6-5-7-16-12)8-17-13(18)14(3,4)9-15/h5-7,10H,8-9,15H2,1-4H3,(H,17,18)
InChIKeyJVUHVSBMGDTVHS-UHFFFAOYSA-N
XLogP1.47
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-amino-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]cyclopropane-1-carboxamide
CID 65464946
2,3-dimethyl-4-oxo-4-[(2-propan-2-yloxy-3-pyridinyl)methylamino]but-2-enoic acid
CID 76992706
N-[(2-propan-2-yloxy-3-pyridinyl)methyl]ethanamine
CID 61373670
(2R)-2-amino-4-methylsulfanyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]butanamide
CID 104908222
N-[(2-propan-2-yloxy-3-pyridinyl)methyl]-1H-pyrazole-4-carboxamide
CID 60975328
methyl 2-[(2-propan-2-yloxy-3-pyridinyl)methylamino]acetate
CID 61375172
(2R)-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]-2-(1,2,4-triazol-1-yl)propanamide
CID 94171586
2-(cyclopropylmethylamino)-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]acetamide
CID 61375381
5-chloro-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrazine-2-carboxamide
CID 107249436
4-chloro-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyridine-3-carboxamide
CID 81229055
2-(3-aminopyrazol-1-yl)-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]acetamide
CID 62113226
1-tert-butyl-5-cyclopropyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrazole-3-carboxamide
CID 55848445

Frequently Asked Questions

What is the IUPAC name of 3-amino-2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]propanamide?
The IUPAC name of 3-amino-2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]propanamide (CID 115426650) is 3-amino-2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]propanamide.
What is the SMILES notation for 3-amino-2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]propanamide?
The canonical SMILES for 3-amino-2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]propanamide is CC(C)Oc1ncccc1CNC(=O)C(C)(C)CN.
What is the InChIKey of 3-amino-2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]propanamide?
The InChIKey is JVUHVSBMGDTVHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-10(2)19-12-11(6-5-7-16-12)8-17-13(18)14(3,4)9-15/h5-7,10H,8-9,15H2,1-4H3,(H,17,18).
What are the key properties of 3-amino-2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]propanamide?
3-amino-2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]propanamide has a molecular weight of 265.36 g/mol, XLogP of 1.47, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]propanamide is sourced from PubChem (CID 115426650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).