4-amino-N-methyl-3-[methyl-[(2-methylcyclopropyl)methyl]amino]butanamide

C11H23N3O — CID 66427575

IUPAC4-amino-N-methyl-3-[methyl-[(2-methylcyclopropyl)methyl]amino]butanamide
SMILESCNC(=O)CC(CN)N(C)CC1CC1C
InChIInChI=1S/C11H23N3O/c1-8-4-9(8)7-14(3)10(6-12)5-11(15)13-2/h8-10H,4-7,12H2,1-3H3,(H,13,15)
InChIKeyAYXNROSOKWDDMQ-UHFFFAOYSA-N
MW213.32 g/mol
LogP0.04
Rot. Bonds6

About 4-amino-N-methyl-3-[methyl-[(2-methylcyclopropyl)methyl]amino]butanamide

4-amino-N-methyl-3-[methyl-[(2-methylcyclopropyl)methyl]amino]butanamide (PubChem CID 66427575) has the molecular formula C11H23N3O and a molecular weight of 213.32 g/mol. Its IUPAC name is 4-amino-N-methyl-3-[methyl-[(2-methylcyclopropyl)methyl]amino]butanamide.

Molecular Properties

Compound Name4-amino-N-methyl-3-[methyl-[(2-methylcyclopropyl)methyl]amino]butanamide
PubChem CID66427575
Molecular FormulaC11H23N3O
Molecular Weight213.32 g/mol
Exact Mass213.18
IUPAC Name4-amino-N-methyl-3-[methyl-[(2-methylcyclopropyl)methyl]amino]butanamide
SMILESCNC(=O)CC(CN)N(C)CC1CC1C
InChIInChI=1S/C11H23N3O/c1-8-4-9(8)7-14(3)10(6-12)5-11(15)13-2/h8-10H,4-7,12H2,1-3H3,(H,13,15)
InChIKeyAYXNROSOKWDDMQ-UHFFFAOYSA-N
XLogP0.04
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 50.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-methyl-3-[methyl-[(2-methylcyclopropyl)methyl]amino]butanamide?
The IUPAC name of 4-amino-N-methyl-3-[methyl-[(2-methylcyclopropyl)methyl]amino]butanamide (CID 66427575) is 4-amino-N-methyl-3-[methyl-[(2-methylcyclopropyl)methyl]amino]butanamide.
What is the SMILES notation for 4-amino-N-methyl-3-[methyl-[(2-methylcyclopropyl)methyl]amino]butanamide?
The canonical SMILES for 4-amino-N-methyl-3-[methyl-[(2-methylcyclopropyl)methyl]amino]butanamide is CNC(=O)CC(CN)N(C)CC1CC1C.
What is the InChIKey of 4-amino-N-methyl-3-[methyl-[(2-methylcyclopropyl)methyl]amino]butanamide?
The InChIKey is AYXNROSOKWDDMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O/c1-8-4-9(8)7-14(3)10(6-12)5-11(15)13-2/h8-10H,4-7,12H2,1-3H3,(H,13,15).
What are the key properties of 4-amino-N-methyl-3-[methyl-[(2-methylcyclopropyl)methyl]amino]butanamide?
4-amino-N-methyl-3-[methyl-[(2-methylcyclopropyl)methyl]amino]butanamide has a molecular weight of 213.32 g/mol, XLogP of 0.04, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-methyl-3-[methyl-[(2-methylcyclopropyl)methyl]amino]butanamide is sourced from PubChem (CID 66427575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).