N-(2-methoxyethyl)-N-propan-2-yl-4-[1-(propylamino)ethyl]pyridin-2-amine

C16H29N3O — CID 82951129

IUPACN-(2-methoxyethyl)-N-propan-2-yl-4-[1-(propylamino)ethyl]pyridin-2-amine
SMILESCCCNC(C)c1ccnc(N(CCOC)C(C)C)c1
InChIInChI=1S/C16H29N3O/c1-6-8-17-14(4)15-7-9-18-16(12-15)19(13(2)3)10-11-20-5/h7,9,12-14,17H,6,8,10-11H2,1-5H3
InChIKeyNXRKTJZQFCDCNA-UHFFFAOYSA-N
MW279.43 g/mol
LogP3.00
Rot. Bonds9

About N-(2-methoxyethyl)-N-propan-2-yl-4-[1-(propylamino)ethyl]pyridin-2-amine

N-(2-methoxyethyl)-N-propan-2-yl-4-[1-(propylamino)ethyl]pyridin-2-amine (PubChem CID 82951129) has the molecular formula C16H29N3O and a molecular weight of 279.43 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-propan-2-yl-4-[1-(propylamino)ethyl]pyridin-2-amine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-propan-2-yl-4-[1-(propylamino)ethyl]pyridin-2-amine
PubChem CID82951129
Molecular FormulaC16H29N3O
Molecular Weight279.43 g/mol
Exact Mass279.23
IUPAC NameN-(2-methoxyethyl)-N-propan-2-yl-4-[1-(propylamino)ethyl]pyridin-2-amine
SMILESCCCNC(C)c1ccnc(N(CCOC)C(C)C)c1
InChIInChI=1S/C16H29N3O/c1-6-8-17-14(4)15-7-9-18-16(12-15)19(13(2)3)10-11-20-5/h7,9,12-14,17H,6,8,10-11H2,1-5H3
InChIKeyNXRKTJZQFCDCNA-UHFFFAOYSA-N
XLogP3.00
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.43
LogP ≤ 53.00
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
4-[1-(ethylamino)ethyl]-N-(2-methoxyethyl)-N-prop-2-enylpyridin-2-amine
CID 103339243
4-(aminomethyl)-N-(2-methoxyethyl)-N-propan-2-ylpyridin-2-amine
CID 82948148
2-[2-methoxyethyl(propan-2-yl)amino]pyridine-4-carboxylic acid
CID 82951662
5-bromo-N-(2-methoxyethyl)-N-propan-2-yl-2-[1-(propylamino)ethyl]aniline
CID 82956232
N,N-bis(2-methoxyethyl)-4-[1-(propylamino)ethyl]aniline
CID 61418340
N-(2-methoxyethyl)-N-propan-2-yl-6-(propylaminomethyl)pyridazin-3-amine
CID 82953348
N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-4-(methylaminomethyl)pyridin-2-amine
CID 62289399
2-[(tert-butylamino)methyl]-N-(2-methoxyethyl)-N-propan-2-ylpyridin-4-amine
CID 82952467
4-(chloromethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)pyridin-2-amine
CID 55005343
4-N-(2-methoxyethyl)-4-N-propan-2-ylpyrimidine-4,6-diamine
CID 82953136
N-[1-[2-[2-(2-methylpropoxy)ethoxy]-4-pyridinyl]ethyl]propan-1-amine
CID 106447868

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-propan-2-yl-4-[1-(propylamino)ethyl]pyridin-2-amine?
The IUPAC name of N-(2-methoxyethyl)-N-propan-2-yl-4-[1-(propylamino)ethyl]pyridin-2-amine (CID 82951129) is N-(2-methoxyethyl)-N-propan-2-yl-4-[1-(propylamino)ethyl]pyridin-2-amine.
What is the SMILES notation for N-(2-methoxyethyl)-N-propan-2-yl-4-[1-(propylamino)ethyl]pyridin-2-amine?
The canonical SMILES for N-(2-methoxyethyl)-N-propan-2-yl-4-[1-(propylamino)ethyl]pyridin-2-amine is CCCNC(C)c1ccnc(N(CCOC)C(C)C)c1.
What is the InChIKey of N-(2-methoxyethyl)-N-propan-2-yl-4-[1-(propylamino)ethyl]pyridin-2-amine?
The InChIKey is NXRKTJZQFCDCNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3O/c1-6-8-17-14(4)15-7-9-18-16(12-15)19(13(2)3)10-11-20-5/h7,9,12-14,17H,6,8,10-11H2,1-5H3.
What are the key properties of N-(2-methoxyethyl)-N-propan-2-yl-4-[1-(propylamino)ethyl]pyridin-2-amine?
N-(2-methoxyethyl)-N-propan-2-yl-4-[1-(propylamino)ethyl]pyridin-2-amine has a molecular weight of 279.43 g/mol, XLogP of 3.00, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-propan-2-yl-4-[1-(propylamino)ethyl]pyridin-2-amine is sourced from PubChem (CID 82951129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).