4-(aminomethyl)-N-(2-methoxyethyl)-N-propan-2-ylpyridin-2-amine

C12H21N3O — CID 82948148

IUPAC4-(aminomethyl)-N-(2-methoxyethyl)-N-propan-2-ylpyridin-2-amine
SMILESCOCCN(c1cc(CN)ccn1)C(C)C
InChIInChI=1S/C12H21N3O/c1-10(2)15(6-7-16-3)12-8-11(9-13)4-5-14-12/h4-5,8,10H,6-7,9,13H2,1-3H3
InChIKeyFSRRPDAJKHKEGO-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.40
Rot. Bonds6

About 4-(aminomethyl)-N-(2-methoxyethyl)-N-propan-2-ylpyridin-2-amine

4-(aminomethyl)-N-(2-methoxyethyl)-N-propan-2-ylpyridin-2-amine (PubChem CID 82948148) has the molecular formula C12H21N3O and a molecular weight of 223.32 g/mol. Its IUPAC name is 4-(aminomethyl)-N-(2-methoxyethyl)-N-propan-2-ylpyridin-2-amine.

Molecular Properties

Compound Name4-(aminomethyl)-N-(2-methoxyethyl)-N-propan-2-ylpyridin-2-amine
PubChem CID82948148
Molecular FormulaC12H21N3O
Molecular Weight223.32 g/mol
Exact Mass223.17
IUPAC Name4-(aminomethyl)-N-(2-methoxyethyl)-N-propan-2-ylpyridin-2-amine
SMILESCOCCN(c1cc(CN)ccn1)C(C)C
InChIInChI=1S/C12H21N3O/c1-10(2)15(6-7-16-3)12-8-11(9-13)4-5-14-12/h4-5,8,10H,6-7,9,13H2,1-3H3
InChIKeyFSRRPDAJKHKEGO-UHFFFAOYSA-N
XLogP1.40
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methoxyethyl)-N-propan-2-yl-4-(propylaminomethyl)pyridin-2-amine
CID 82952306
2-[2-methoxyethyl(propan-2-yl)amino]pyridine-4-carboxylic acid
CID 82951662
4-(chloromethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)pyridin-2-amine
CID 55005343
N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-4-(methylaminomethyl)pyridin-2-amine
CID 62289399
N-(2-methoxyethyl)-N-propan-2-yl-4-[1-(propylamino)ethyl]pyridin-2-amine
CID 82951129
4-N-(2-methoxyethyl)-4-N-propan-2-ylpyrimidine-4,6-diamine
CID 82953136
4-(aminomethyl)-3-chloro-N-(2-methoxyethyl)-N-propan-2-ylpyridin-2-amine
CID 107055721
4-(aminomethyl)-N-propan-2-yl-N-(thiophen-2-ylmethyl)pyridin-2-amine
CID 54948539
N-(2-methoxyethyl)-4-(methylaminomethyl)-N-pentan-3-ylpyridin-2-amine
CID 62288159
2-[(tert-butylamino)methyl]-N-(2-methoxyethyl)-N-propan-2-ylpyridin-4-amine
CID 82952467
N'-[4-(aminomethyl)-2-pyridinyl]-N,N-dimethyl-N'-(2-methylpropyl)ethane-1,2-diamine
CID 55006973
4-(ethylaminomethyl)-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridin-2-amine
CID 55059734

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-N-(2-methoxyethyl)-N-propan-2-ylpyridin-2-amine?
The IUPAC name of 4-(aminomethyl)-N-(2-methoxyethyl)-N-propan-2-ylpyridin-2-amine (CID 82948148) is 4-(aminomethyl)-N-(2-methoxyethyl)-N-propan-2-ylpyridin-2-amine.
What is the SMILES notation for 4-(aminomethyl)-N-(2-methoxyethyl)-N-propan-2-ylpyridin-2-amine?
The canonical SMILES for 4-(aminomethyl)-N-(2-methoxyethyl)-N-propan-2-ylpyridin-2-amine is COCCN(c1cc(CN)ccn1)C(C)C.
What is the InChIKey of 4-(aminomethyl)-N-(2-methoxyethyl)-N-propan-2-ylpyridin-2-amine?
The InChIKey is FSRRPDAJKHKEGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O/c1-10(2)15(6-7-16-3)12-8-11(9-13)4-5-14-12/h4-5,8,10H,6-7,9,13H2,1-3H3.
What are the key properties of 4-(aminomethyl)-N-(2-methoxyethyl)-N-propan-2-ylpyridin-2-amine?
4-(aminomethyl)-N-(2-methoxyethyl)-N-propan-2-ylpyridin-2-amine has a molecular weight of 223.32 g/mol, XLogP of 1.40, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-N-(2-methoxyethyl)-N-propan-2-ylpyridin-2-amine is sourced from PubChem (CID 82948148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).