2-(aminomethyl)-N-(2-cyclopropyl-2-hydroxyethyl)butanamide

C10H20N2O2 — CID 65227956

IUPAC2-(aminomethyl)-N-(2-cyclopropyl-2-hydroxyethyl)butanamide
SMILESCCC(CN)C(=O)NCC(O)C1CC1
InChIInChI=1S/C10H20N2O2/c1-2-7(5-11)10(14)12-6-9(13)8-3-4-8/h7-9,13H,2-6,11H2,1H3,(H,12,14)
InChIKeyNDTTYAJBXUPOGX-UHFFFAOYSA-N
MW200.28 g/mol
LogP-0.14
Rot. Bonds6

About 2-(aminomethyl)-N-(2-cyclopropyl-2-hydroxyethyl)butanamide

2-(aminomethyl)-N-(2-cyclopropyl-2-hydroxyethyl)butanamide (PubChem CID 65227956) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 2-(aminomethyl)-N-(2-cyclopropyl-2-hydroxyethyl)butanamide.

Molecular Properties

Compound Name2-(aminomethyl)-N-(2-cyclopropyl-2-hydroxyethyl)butanamide
PubChem CID65227956
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name2-(aminomethyl)-N-(2-cyclopropyl-2-hydroxyethyl)butanamide
SMILESCCC(CN)C(=O)NCC(O)C1CC1
InChIInChI=1S/C10H20N2O2/c1-2-7(5-11)10(14)12-6-9(13)8-3-4-8/h7-9,13H,2-6,11H2,1H3,(H,12,14)
InChIKeyNDTTYAJBXUPOGX-UHFFFAOYSA-N
XLogP-0.14
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 5-0.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-cyclopropyl-2-hydroxyethyl)-2-ethylbutanamide
CID 63294520
3-chloro-N-(2-cyclopropyl-2-hydroxyethyl)-2-methylpropanamide
CID 63296375
2-(aminomethyl)-N-(2-methylbutyl)butanamide
CID 62691581
N-(2-bromo-2-cyclopropylethyl)-2-ethylbutanamide
CID 114315794
2-(aminomethyl)-N-(1-cyclohexylethyl)butanamide
CID 62405592
3-amino-N-(2-cyclopropyl-2-hydroxyethyl)propanamide
CID 63297161
2-amino-N-(2-cyclopropyl-2-hydroxyethyl)-2-ethylbutanamide
CID 79814450
2-amino-N-(2-cyclopropyl-2-hydroxyethyl)butanediamide
CID 63296967
2-(aminomethyl)-N-(3-aminopropyl)butanamide
CID 65229428
N-(3-amino-2-methylpropyl)-2-(cyclohexylmethyl)butanamide;hydrochloride
CID 119996125
2-amino-N-(2-cyclopropyl-2-hydroxyethyl)-2-methylpropanamide
CID 63297255
N-(2-cyclopropyl-2-hydroxyethyl)-4-ethylbenzamide
CID 63294170

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-(2-cyclopropyl-2-hydroxyethyl)butanamide?
The IUPAC name of 2-(aminomethyl)-N-(2-cyclopropyl-2-hydroxyethyl)butanamide (CID 65227956) is 2-(aminomethyl)-N-(2-cyclopropyl-2-hydroxyethyl)butanamide.
What is the SMILES notation for 2-(aminomethyl)-N-(2-cyclopropyl-2-hydroxyethyl)butanamide?
The canonical SMILES for 2-(aminomethyl)-N-(2-cyclopropyl-2-hydroxyethyl)butanamide is CCC(CN)C(=O)NCC(O)C1CC1.
What is the InChIKey of 2-(aminomethyl)-N-(2-cyclopropyl-2-hydroxyethyl)butanamide?
The InChIKey is NDTTYAJBXUPOGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-2-7(5-11)10(14)12-6-9(13)8-3-4-8/h7-9,13H,2-6,11H2,1H3,(H,12,14).
What are the key properties of 2-(aminomethyl)-N-(2-cyclopropyl-2-hydroxyethyl)butanamide?
2-(aminomethyl)-N-(2-cyclopropyl-2-hydroxyethyl)butanamide has a molecular weight of 200.28 g/mol, XLogP of -0.14, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-(2-cyclopropyl-2-hydroxyethyl)butanamide is sourced from PubChem (CID 65227956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).