2-(aminomethyl)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide

C13H21N3O2 — CID 65229294

IUPAC2-(aminomethyl)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide
SMILESCCC(CN)C(=O)Nc1cccnc1OC(C)C
InChIInChI=1S/C13H21N3O2/c1-4-10(8-14)12(17)16-11-6-5-7-15-13(11)18-9(2)3/h5-7,9-10H,4,8,14H2,1-3H3,(H,16,17)
InChIKeyOYFCFWZSWUAMIT-UHFFFAOYSA-N
MW251.33 g/mol
LogP1.79
Rot. Bonds6

About 2-(aminomethyl)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide

2-(aminomethyl)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide (PubChem CID 65229294) has the molecular formula C13H21N3O2 and a molecular weight of 251.33 g/mol. Its IUPAC name is 2-(aminomethyl)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide.

Molecular Properties

Compound Name2-(aminomethyl)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide
PubChem CID65229294
Molecular FormulaC13H21N3O2
Molecular Weight251.33 g/mol
Exact Mass251.16
IUPAC Name2-(aminomethyl)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide
SMILESCCC(CN)C(=O)Nc1cccnc1OC(C)C
InChIInChI=1S/C13H21N3O2/c1-4-10(8-14)12(17)16-11-6-5-7-15-13(11)18-9(2)3/h5-7,9-10H,4,8,14H2,1-3H3,(H,16,17)
InChIKeyOYFCFWZSWUAMIT-UHFFFAOYSA-N
XLogP1.79
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-3-methyl-N-(2-propan-2-yloxy-3-pyridinyl)pentanamide
CID 61379490
2-bromo-N-(2-propan-2-yloxy-3-pyridinyl)butanamide
CID 62855618
(2S)-2-amino-3-methyl-N-(2-propan-2-yloxy-3-pyridinyl)butanamide
CID 61379065
2-chloro-N-(2-propan-2-yloxy-3-pyridinyl)propanamide
CID 61379626
4-amino-3-methoxy-N-(2-propan-2-yloxy-3-pyridinyl)butanamide
CID 103155628
6-amino-2-methyl-N-(2-propan-2-yloxy-3-pyridinyl)heptanamide
CID 65291888
2-(2-aminoethoxy)-N-(2-propan-2-yloxy-3-pyridinyl)acetamide
CID 79479427
1-(3-methylbutyl)-3-(2-propan-2-yloxy-3-pyridinyl)urea
CID 112831617
4-oxo-4-[(2-propan-2-yloxy-3-pyridinyl)amino]butanoic acid
CID 61379431
3-(ethylamino)-N-(2-propan-2-yloxy-3-pyridinyl)propanamide
CID 62834244
N-butan-2-yl-2-propan-2-yloxypyridin-3-amine
CID 61374234
N-ethyl-2-propan-2-yloxypyridin-3-amine
CID 61374229

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide?
The IUPAC name of 2-(aminomethyl)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide (CID 65229294) is 2-(aminomethyl)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide.
What is the SMILES notation for 2-(aminomethyl)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide?
The canonical SMILES for 2-(aminomethyl)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide is CCC(CN)C(=O)Nc1cccnc1OC(C)C.
What is the InChIKey of 2-(aminomethyl)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide?
The InChIKey is OYFCFWZSWUAMIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2/c1-4-10(8-14)12(17)16-11-6-5-7-15-13(11)18-9(2)3/h5-7,9-10H,4,8,14H2,1-3H3,(H,16,17).
What are the key properties of 2-(aminomethyl)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide?
2-(aminomethyl)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide has a molecular weight of 251.33 g/mol, XLogP of 1.79, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide is sourced from PubChem (CID 65229294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).