2-(3-amino-5-methylpiperidin-1-yl)-N-(2-methylbutan-2-yl)propanamide

C14H29N3O — CID 79993020

IUPAC2-(3-amino-5-methylpiperidin-1-yl)-N-(2-methylbutan-2-yl)propanamide
SMILESCCC(C)(C)NC(=O)C(C)N1CC(C)CC(N)C1
InChIInChI=1S/C14H29N3O/c1-6-14(4,5)16-13(18)11(3)17-8-10(2)7-12(15)9-17/h10-12H,6-9,15H2,1-5H3,(H,16,18)
InChIKeySQYRQNMNYKALDQ-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.35
Rot. Bonds4

About 2-(3-amino-5-methylpiperidin-1-yl)-N-(2-methylbutan-2-yl)propanamide

2-(3-amino-5-methylpiperidin-1-yl)-N-(2-methylbutan-2-yl)propanamide (PubChem CID 79993020) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 2-(3-amino-5-methylpiperidin-1-yl)-N-(2-methylbutan-2-yl)propanamide.

Molecular Properties

Compound Name2-(3-amino-5-methylpiperidin-1-yl)-N-(2-methylbutan-2-yl)propanamide
PubChem CID79993020
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name2-(3-amino-5-methylpiperidin-1-yl)-N-(2-methylbutan-2-yl)propanamide
SMILESCCC(C)(C)NC(=O)C(C)N1CC(C)CC(N)C1
InChIInChI=1S/C14H29N3O/c1-6-14(4,5)16-13(18)11(3)17-8-10(2)7-12(15)9-17/h10-12H,6-9,15H2,1-5H3,(H,16,18)
InChIKeySQYRQNMNYKALDQ-UHFFFAOYSA-N
XLogP1.35
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-aminopyrrolidin-1-yl)-N-(2-methylbutan-2-yl)propanamide
CID 62068958
2-(3-amino-5-methylpiperidin-1-yl)-N-methylpropanamide
CID 79993684
2-(3-amino-5-methylpiperidin-1-yl)-N-pentan-3-ylpropanamide
CID 79993821
2-(3,5-dimethylpiperazin-1-yl)-N-(2-methylbutan-2-yl)propanamide
CID 63874811
2-(3-amino-5-methylpiperidin-1-yl)-N-propan-2-ylpropanamide
CID 79994470
2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N-(2-methylbutan-2-yl)propanamide
CID 102938963
2-[4-(aminomethyl)piperidin-1-yl]-N-(2-methylbutan-2-yl)propanamide
CID 55210355
2-[4-(aminomethyl)piperidin-1-yl]-N-(2-methylbutan-2-yl)propanamide;hydrochloride
CID 119909909
N-(2-methylbutan-2-yl)-2-[4-[(propan-2-ylamino)methyl]piperidin-1-yl]propanamide
CID 63847901
(2S)-N-(tert-butylcarbamoyl)-2-[(3S,5S)-3,5-dimethylpiperidin-1-yl]propanamide
CID 9430972
2-[2-(aminomethyl)-4-methylpiperazin-1-yl]-N-(2-methylbutan-2-yl)propanamide
CID 80507190
2-(3-aminoazetidin-1-yl)-N-cyclopropylpropanamide
CID 63761129

Frequently Asked Questions

What is the IUPAC name of 2-(3-amino-5-methylpiperidin-1-yl)-N-(2-methylbutan-2-yl)propanamide?
The IUPAC name of 2-(3-amino-5-methylpiperidin-1-yl)-N-(2-methylbutan-2-yl)propanamide (CID 79993020) is 2-(3-amino-5-methylpiperidin-1-yl)-N-(2-methylbutan-2-yl)propanamide.
What is the SMILES notation for 2-(3-amino-5-methylpiperidin-1-yl)-N-(2-methylbutan-2-yl)propanamide?
The canonical SMILES for 2-(3-amino-5-methylpiperidin-1-yl)-N-(2-methylbutan-2-yl)propanamide is CCC(C)(C)NC(=O)C(C)N1CC(C)CC(N)C1.
What is the InChIKey of 2-(3-amino-5-methylpiperidin-1-yl)-N-(2-methylbutan-2-yl)propanamide?
The InChIKey is SQYRQNMNYKALDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-6-14(4,5)16-13(18)11(3)17-8-10(2)7-12(15)9-17/h10-12H,6-9,15H2,1-5H3,(H,16,18).
What are the key properties of 2-(3-amino-5-methylpiperidin-1-yl)-N-(2-methylbutan-2-yl)propanamide?
2-(3-amino-5-methylpiperidin-1-yl)-N-(2-methylbutan-2-yl)propanamide has a molecular weight of 255.41 g/mol, XLogP of 1.35, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-amino-5-methylpiperidin-1-yl)-N-(2-methylbutan-2-yl)propanamide is sourced from PubChem (CID 79993020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).